SCHEMBL41135

SCHEMBL41135

CS(=O)(=O)O.C[C@H](NC1[C@H]2CN(c3nc4c(cc3F)c(=O)c(C(=O)O)cn4-c3ccc(F)cc3F)C[C@@H]12)C(=O)NC(=O)[C@@H](C)N

nearest known ligand 0.72

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT4 known ✓ P35916 1/20 0.65
SLC6A3 known ✓ Q01959 1/20 0.65
DRD1 known ✓ P21728 1/20 0.35
LMNA P02545 5/20 0.72
KDM4E B2RXH2 5/20 0.72
HSD17B10 Q99714 3/20 0.72
ALDH1A1 P00352 3/20 0.72
HPGD P15428 3/20 0.72
POLB P06746 1/20 0.72
XBP1 P17861 1/20 0.72
NFKB1 P19838 1/20 0.72
HTT P42858 1/20 0.72
NFKB2 Q00653 1/20 0.72
RELA Q04206 1/20 0.72
EPHA2 P29317 1/20 0.65
GSK3B P49841 1/20 0.65
RARB P10826 1/20 0.65
TBXAS1 P24557 1/20 0.65
KMT2A Q03164 3/20 0.57
DPP4 P27487 6/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8191327 1.00 LMNA (0.72) LMNAKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL13576349 0.97 EPHA2 (0.68) LMNAKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL140568 0.97 EPHA2 (0.68) LMNAKDM4EHSD17B10ALDH1A1HPGD
Alatrofloxacin SCHEMBL8186971 0.90 LMNA (0.73) LMNAKDM4EHSD17B10ALDH1A1HPGD
Alatrofloxacin SCHEMBL29389843 0.90 LMNA (0.73) LMNAKDM4EHSD17B10ALDH1A1HPGD
Alatrofloxacin SCHEMBL41134 0.90 LMNA (0.73) LMNAKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL9735079 0.88 EPHA2 (0.74) LMNAKDM4EHSD17B10ALDH1A1HPGD
Alatrofloxacin SCHEMBL140567 0.86 EPHA2 (0.69) LMNAKDM4EHSD17B10ALDH1A1HPGD
Alatrofloxacin SCHEMBL29493446 0.86 EPHA2 (0.69) LMNAKDM4EHSD17B10ALDH1A1HPGD
Alatrofloxacin SCHEMBL7101443 0.86 EPHA2 (0.69) LMNAKDM4EHSD17B10ALDH1A1HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 696 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3452124-B1 HEMOSTATIC DEVICES AND METHODS OF USE MEDTRONIC INC (US) 2025-10-08 EP claimed
EP-3452123-B1 HEMOSTATIC DEVICES AND METHODS OF USE MEDTRONIC INC (US) 2025-09-24 EP claimed
EP-3230500-B1 METHODS OF ORIENTING MULTIFILAMENT YARN AND MONOFILAMENTS OF POLY-4-HYDROXYBUTYRATE AND COPOLYMERS THEREOF TEPHA INC (US) 2025-06-18 EP claimed
US-20250099557-A1 ANTIBIOTIC PHARMACEUTICAL COMPOSITION CAPABLE OF SUBCUTANEOUS ADMINISTRATION SHANGHAI BAO PHARMACEUTICALS CO., LTD. (CN) 2025-03-27 US claimed
EP-4525870-A1 METHODS OF TREATING CUSHING'S SYNDROME AND LIVER DISORDERS, AND OF REDUCING LIVER TOXICITY OF OTHER DRUGS ADMINISTERED TO A PATIENT Corcept Therapeutics Incorporated (US) 2025-03-26 EP claimed
EP-3678715-B1 CALENDERED SURGICAL MESHES COMPRISING POLYHYDROXYALKANOATES TEPHA INC (US) 2024-10-30 EP claimed
EP-4442767-A2 METHODS FOR 3D PRINTING OF POLY-4-HYDROXYBUTYRATE Tepha, Inc. (US) 2024-10-09 EP claimed
EP-3802062-B1 METHODS FOR 3D PRINTING OF POLY-4-HYDROXYBUTYRATE TEPHA INC (US) 2024-09-18 EP claimed
US-20240245659-A1 Methods of Treating Cushing's Syndrome and Liver Disorders, and of Reducing Liver Toxicity of Other Drugs Administered to a Patient CORCEPT THERAPEUTICS INCORPORATED (US) 2024-07-25 US claimed
EP-4374848-A1 ANTIBIOTIC PHARMACEUTICAL COMPOSITION CAPABLE OF SUBCUTANEOUS ADMINISTRATION Shanghai Bao Pharmaceuticals Co., Ltd. (CN) 2024-05-29 EP claimed
WO-2017192494-A1 HEMOSTATIC DEVICES AND METHODS OF USE TYRX, INC. (US) 2017-11-09 WO claimed
US-20170319754-A1 HEMOSTATIC DEVICES AND METHODS OF USE TYRX, INC. (US) 2017-11-09 US claimed
EP-3230500-A1 METHODS OF ORIENTING MULTIFILAMENT YARN AND MONOFILAMENTS OF POLY-4-HYDROXYBUTYRATE AND COPOLYMERS THEREOF Tepha, Inc. (US) 2017-10-18 EP claimed
EP-3197512-A1 ORIENTED P4HB IMPLANTS CONTAINING ANTIMICROBIAL AGENTS Tepha, Inc. (US) 2017-08-02 EP claimed
US-20170081784-A1 METHODS OF ORIENTING MULTIFILAMENT YARN AND MONOFILAMENTS OF POLY-4-HYDROXYBUTYRATE AND COPOLYMERS THEREOF TEPHA, INC. 2017-03-23 US claimed
US-9555155-B2 Methods of orienting multifilament yarn and monofilaments of poly-4-hydroxybutyrate and copolymers thereof TEPHA, INC. (US) 2017-01-31 US claimed
US-20160166727-A1 Methods of Orienting Multifilament Yarn and Monofilaments of Poly-4-Hydroxybutyrate and Copolymers Thereof TEPHA, INC. 2016-06-16 US claimed
WO-2016048950-A1 ORIENTED P4HB IMPLANTS CONTAINING ANTIMICROBIAL AGENTS TEPHA, INC. (US) 2016-03-31 WO claimed
US-20160082160-A1 ORIENTED P4HB IMPLANTS CONTAINING ANTIMICROBIAL AGENTS TEPHA, INC. 2016-03-24 US claimed
EP-1121933-A1 Premixed alatrofloxacin injectable compositions Pfizer Products Inc. (US) 2001-08-08 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240245659-A1 Methods of Treating Cushing's Syndrome and Liver Disorders, and of Reducing Liver Toxicity of Other Drugs Administered to a Patient CYP3A43, NR3C2, CYP3A5 FLT4 978/4885SLC6A3 842/4885DRD1 2493/4885
US-20170319754-A1 HEMOSTATIC DEVICES AND METHODS OF USE PLAT, HABP2, F2 FLT4 2820/4885SLC6A3 4838/4885DRD1 4790/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.