SCHEMBL2170893

SCHEMBL2170893

COC(=O)C(C)c1ccc(N)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.50
SLC6A3 Q01959 1/20 0.47
MT-CO2 P00403 1/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
CXCR1 P25024 1/20 0.44
CXCR2 P25025 1/20 0.44
KMT2A Q03164 1/20 0.42
SCN1A P35498 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN3A Q9NY46 1/20 0.41
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAOA P21397 1/20 0.40
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40

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
SCHEMBL1345587 1.00 HPGD (0.50) HPGDSLC6A3MT-CO2PTGS1PTGS2
SCHEMBL262458 1.00 HPGD (0.50) HPGDSLC6A3MT-CO2PTGS1PTGS2
Hydrochloric Acid SCHEMBL6792900 0.98 HPGD (0.49) HPGDSLC6A3MT-CO2PTGS1PTGS2
SCHEMBL11130803 0.88 HPGD (0.53) HPGDMT-CO2PTGS1PTGS2CXCR1
SCHEMBL12896284 0.88 HPGD (0.53) HPGDMT-CO2PTGS1PTGS2CXCR1
SCHEMBL1000872 0.84 LMNA (0.40) HPGDSLC6A3PTGS2CXCR1CXCR2
SCHEMBL22838087 0.82 KMT2A (0.55) HPGDSLC6A3KMT2ASCN1ASCN2A
SCHEMBL1747458 0.82 ESR1 (0.56) HPGDMT-CO2PTGS1PTGS2KMT2A
SCHEMBL3526852 0.82 ALDH1A1 (0.56) SLC6A3KMT2ASCN1ASCN2ASCN3A
SCHEMBL12424105 0.82 HPGD (0.51) HPGDMT-CO2PTGS1PTGS2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117841495-A Polypropylene synthetic paper with ultrahigh interlayer binding force and preparation method thereof 烟台富利新材料科技有限公司 2024-04-09 CN claimed
EP-4743082-A1 CARBAZOLE COMPOUNDS AND THEIR USE IN THERAPY, IN THE TREATMENT OF A RESPIRATORY INFECTION UCL Business Ltd (GB) 2026-05-20 EP disclosed
WO-2025012634-A1 CARBAZOLE COMPOUNDS AND THEIR USE IN THERAPY, IN THE TREATMENT OF A RESPIRATORY INFECTION UCL BUSINESS LTD (GB) 2025-01-16 WO disclosed
CN-117841495-A Polypropylene synthetic paper with ultrahigh interlayer binding force and preparation method thereof 烟台富利新材料科技有限公司 2024-04-09 CN disclosed
CN-117841495-A Polypropylene synthetic paper with ultrahigh interlayer binding force and preparation method thereof 烟台富利新材料科技有限公司 2024-04-09 CN disclosed
CN-114292226-B Compound with hydroxamic acid structure and preparation method and application thereof 沈阳药科大学 2023-04-18 CN disclosed
US-20220324803-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF TEON THERAPEUTICS INC (US) 2022-10-13 US disclosed
EP-4019518-A1 TYK2 INHIBITORS AND USES THEREOF Nimbus Lakshmi, Inc. (US) 2022-06-29 EP disclosed
EP-4019518-A1 TYK2 INHIBITORS AND USES THEREOF Nimbus Lakshmi, Inc. (US) 2022-06-29 EP disclosed
EP-3983412-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF Teon Therapeutics, Inc. (US) 2022-04-20 EP disclosed
US-4308208-A α-Methylthio-α-(p-phthalimidophenyl)-propionic acid SAGAMI CHEMICAL RESEARCH CENTER (JP) 1981-12-29 US disclosed
US-4278802-A METHYLTHIO-/P-/2-THIENYLCARBONYL/PHENYL/PROPIONIC ACID OR ESTER, PHARMACEUTICAL INTERMEDIATES SAGAMI CHEMICAL RESEARCH CENTER (JP) 1981-07-14 US disclosed
US-4256753-A ANTIINFLAMMATORY AGENTS, ANALGESICS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1981-03-17 US disclosed
US-4242519-A DRUG INTERMEDIATES SAGAMI CHEMICAL RESEARCH CENTER (JP) 1980-12-30 US disclosed
US-4237298-A Aromatic acetic acid derivatives having sulfur atom at alpha-position and process for their preparation SAGAMI CHEMICAL RESEARCH CENTER (JP) 1980-12-02 US disclosed
EP-0011854-A1 4-(2'-Pyridylamino)-phenylacetic acid derivatives, process for their preparation, pharmaceuticals containing these compounds and their use Dainippon Pharmaceutical Co., Ltd. (JP) 1980-06-11 EP disclosed
EP-0011854-A1 4-(2'-Pyridylamino)-phenylacetic acid derivatives, process for their preparation, pharmaceuticals containing these compounds and their use Dainippon Pharmaceutical Co., Ltd. (JP) 1980-06-11 EP disclosed
US-4144248-A Aromatic acetic acid derivatives having sulfur atom at alpha-position and process for their preparation SAGAMI CHEMICAL RESEARCH CENTER (JP) 1979-03-13 US disclosed
US-3973022-A Quinolineacetic acid compositions CIBA-GEIGY CORPORATION (US) 1976-08-03 US disclosed
US-3957850-A ANALGESICS, ANTIINFLAMMATORY AGENTS BOUCHARA EMILE 1976-05-18 US 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 (1 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-20220324803-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF PTGER4, PTGER1, PTGER2 HPGD 42/4885SLC6A3 4136/4885MT-CO2 2122/4885

“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.