SCHEMBL29588162

SCHEMBL29588162

On1c(-c2ccccc2)nc2ccc(Cl)cc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 1.00
RAB9A P51151 4/20 1.00
NPC1 O15118 3/20 1.00
SMN1; SMN2 Q16637 3/20 1.00
CYP1A2 P05177 1/20 1.00
GAA P10253 1/20 1.00
CYP2C9 P11712 1/20 1.00
CYP2C19 P33261 1/20 1.00
MEN1 O00255 7/20 0.67
KMT2A Q03164 7/20 0.67
HTT P42858 4/20 0.67
LMNA P02545 3/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
CASP3 P42574 1/20 0.62
SENP8 Q96LD8 1/20 0.62
SENP7 Q9BQF6 1/20 0.62
SENP6 Q9GZR1 1/20 0.62
ALDH1A1 P00352 2/20 0.55
HPGD P15428 1/20 0.55
MAPT P10636 3/20 0.50

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
SCHEMBL3639863 1.00 KDM4E (1.00) KDM4ERAB9ANPC1SMN1; SMN2CYP1A2
Phosphine SCHEMBL15543212 0.98 KDM4E (0.97) KDM4ERAB9ANPC1SMN1; SMN2CYP1A2
SCHEMBL5334468 0.90 RAB9A (0.82) KDM4ERAB9ANPC1SMN1; SMN2CYP1A2
SCHEMBL3639865 0.87 KDM4E (0.77) KDM4ERAB9ANPC1SMN1; SMN2CYP1A2
SCHEMBL14922007 0.82 KDM4E (0.69) KDM4ERAB9ANPC1SMN1; SMN2CYP1A2
SCHEMBL12325957 0.81 KDM4E (0.68) KDM4ERAB9ANPC1SMN1; SMN2CYP1A2
SCHEMBL3668854 0.81 RAB9A (0.68) KDM4ERAB9ANPC1SMN1; SMN2CYP1A2
SCHEMBL12325283 0.80 KMT2A (1.00) KDM4ERAB9ANPC1SMN1; SMN2CYP1A2
SCHEMBL23024881 0.79 RAB9A (0.66) KDM4ERAB9ANPC1SMN1; SMN2CYP1A2
SCHEMBL29475390 0.79 KDM4E (0.74) KDM4ERAB9ANPC1SMN1; SMN2CYP1A2

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117843761-A Method for preparing melanocortin analogue cyclic peptide drug based on hydrophobic label carrier 浙江工业大学 2024-04-09 CN claimed
CN-117843715-A Liquid phase synthesis method of melanoputan-II 浙江工业大学 2024-04-09 CN claimed
CN-115093460-A Method for synthesizing linaclotide intermediate and linaclotide in full liquid phase 浙江工业大学 2022-09-23 CN claimed
US-20260137765-A1 METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STXB) MONOMERS AND OLIGOMERS, AND USES THEREOF INSTITUT CURIE (FR) 2026-05-21 US disclosed
US-12527854-B2 Methods of producing Shiga toxin B-subunit (STxB) monomers and oligomers, and uses thereof INSTITUT CURIE (FR) 2026-01-20 US disclosed
EP-3856164-B1 MORPHIC FORMS OF COMPLEMENT FACTOR D INHIBITORS ACHILLION PHARMACEUTICALS INC (US) 2024-08-07 EP disclosed
CN-117843761-A Method for preparing melanocortin analogue cyclic peptide drug based on hydrophobic label carrier 浙江工业大学 2024-04-09 CN disclosed
CN-117843715-A Liquid phase synthesis method of melanoputan-II 浙江工业大学 2024-04-09 CN disclosed
US-11807627-B2 Morphic forms of complement factor D inhibitors Achillon Pharmaceuticals, Inc. (US) 2023-11-07 US disclosed
US-20230331751-A1 STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES Atea Pharmaceuticals, Inc. (US) 2023-10-19 US disclosed
CN-115884977-A Stereoselective preparation of selected purine phosphoramidates 阿堤亚制药公司 2023-03-31 CN disclosed
CN-115093460-A Method for synthesizing linaclotide intermediate and linaclotide in full liquid phase 浙江工业大学 2022-09-23 CN disclosed
US-20220233673-A1 METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STxB) MONOMERS AND OLIGOMERS, AND USES THEREOF INSTITUT CURIE (FR) 2022-07-28 US disclosed
EP-3980057-A1 METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STXB) MONOMERS AND OLIGOMERS, AND USES THEREOF Institut Curie (FR) 2022-04-13 EP disclosed

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

For each of this compound's patents that has machine-readable text (4 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-12527854-B2 Methods of producing Shiga toxin B-subunit (STxB) monomers and oligomers, and uses thereof STXBP1, RNGTT, UPF1 KDM4E 2432/4885RAB9A 1465/4885NPC1 4761/4885
US-11807627-B2 Morphic forms of complement factor D inhibitors CFD, CFH, CFB KDM4E 2408/4885RAB9A 1921/4885NPC1 1227/4885
US-20260137765-A1 METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STXB) MONOMERS AND OLIGOMERS, AND USES THEREOF STXBP1, HBB, UPF1 KDM4E 2972/4885RAB9A 1754/4885NPC1 4724/4885
US-20230331751-A1 STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES NUDT1, PNP, ATIC KDM4E 3678/4885RAB9A 1398/4885NPC1 1054/4885

“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.