SCHEMBL18699

SCHEMBL18699

O=Cc1cc(Br)ccc1F

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 5/20 0.57
CYP2A6 P11509 3/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.43
PTPN1 P18031 1/20 0.41
ALDH1A1 P00352 1/20 0.40
DGAT1 O75907 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GPR183 P32249 1/20 0.38
PIM3 Q86V86 1/20 0.37

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
SCHEMBL29525291 1.00 ERN1 (0.57) ERN1CYP2A6PTGDR2PTPN1ALDH1A1
SCHEMBL30037767 1.00 ERN1 (0.57) ERN1CYP2A6PTGDR2PTPN1ALDH1A1
SCHEMBL20465744 0.82 ERN1 (0.52) ERN1CYP2A6PTGDR2PTPN1ALDH1A1
SCHEMBL19429 0.82 ERN1 (0.52) ERN1CYP2A6PTGDR2PTPN1ALDH1A1
SCHEMBL21676110 0.79 SMN1; SMN2 (0.42) ERN1CYP2A6PTGDR2ALDH1A1DGAT1
SCHEMBL3040456 0.78 ERN1 (0.64) ERN1CYP2A6PTGDR2PTPN1ALDH1A1
SCHEMBL16960006 0.77 ERN1 (0.42) ERN1PTGDR2ALDH1A1DGAT1SMN1; SMN2
SCHEMBL2286127 0.77 ERN1 (0.38) ERN1ALDH1A1DGAT1SMN1; SMN2GPR183
SCHEMBL27701174 0.77 ERN1 (0.38) ERN1ALDH1A1DGAT1SMN1; SMN2GPR183
SCHEMBL65723 0.76 ERN1 (0.56) ERN1PTPN1ALDH1A1

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 1881 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119119116-A Rhein phosphoryl derivative and synthetic method and application thereof 甘肃中医药大学 2024-12-13 CN claimed
CN-113912544-B Preparation method of 5-bromo-1-methylindazole 沧州普瑞东方科技有限公司 2023-03-17 CN claimed
CN-113912544-A Preparation method of 5-bromo-1-methylindazole 沧州普瑞东方科技有限公司 2022-01-11 CN claimed
CN-108623558-A A kind of synthetic method of 2- (the bromo- 2- luorobenzyls of 5-) benzothiophene 瑞孚信江苏药业股份有限公司 2018-10-09 CN claimed
CN-105924403-B A kind of ring propane diamide compound with anti-tumor activity and its preparation method and application 西安交通大学 2018-07-17 CN claimed
CN-105924385-A Diarylthiourea compound with antitumor activity, and preparation method and application thereof 西安交通大学 2016-09-07 CN claimed
CN-105924403-A Cyclomalonamide compound with antitumor activity, and preparation method and application thereof 西安交通大学 2016-09-07 CN claimed
CN-104744358-A Pyridine formylhydrazine compounds with insecticidal activity and preparation method and application thereof UNIV ZHEJIANG TECHNOLOGY 2015-07-01 CN claimed
EP-1651648-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-09-02 EP claimed
JP-2007500725-A 2007-01-18 JP claimed
EP-1651648-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-03 EP claimed
WO-2005011597-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-02-10 WO claimed
US-12630561-B2 Tricyclic derivatives inhibitor, preparation method, and applications thereof JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2026-05-19 US disclosed
CN-122036699-A THR-beta modulators and methods of use thereof 阿利戈斯治疗公司 2026-05-15 CN disclosed
CN-122010910-A Biazacycloalkane Menin-MLL protein inhibitor, pharmaceutical composition and application thereof 赛诺哈勃药业(成都)有限公司 2026-05-12 CN disclosed
US-12624050-B2 Three fused ring derivative-containing salt or crystal form and pharmaceutical composition thereof SHANGHAI HANSOH BIOMEDICAL CO., LTD. (CN) 2026-05-12 US disclosed
US-5731315-A Substituted sulfonic acid n- (aminoiminomethyl)phenylalkyl!-azaheterocyclamide compounds RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-03-24 US disclosed
US-5489592-A ALDOSE REDUCTASE INHIBITORS FOR TREATMENT OF DIABETES-RELATED DISORDERS LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1996-02-06 US disclosed
EP-0607344-A1 3,4-DIHYDRO-4-OXO-3-(PROP-2-ENYL)-1-PHTALAZINEACETIC ACIDS AND DERIVATIVES, PREPARATIONS THEREOF AND DRUGS CONTAINING SAME LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1994-07-27 EP disclosed
WO-1993007109-A1 3,4-DIHYDRO-4-OXO-3-(PROP-2-ENYL)-1-PHTALAZINEACETIC ACIDS AND DERIVATIVES, PREPARATIONS THEREOF AND DRUGS CONTAINING SAME LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1993-04-15 WO 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 (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-12624050-B2 Three fused ring derivative-containing salt or crystal form and pharmaceutical composition thereof OGDH, ME1, GCDH ERN1 3645/4885CYP2A6 639/4885PTGDR2 1578/4885
US-12630561-B2 Tricyclic derivatives inhibitor, preparation method, and applications thereof PIK3CA, PIK3R1, PIK3CD ERN1 1001/4885CYP2A6 404/4885PTGDR2 2111/4885

“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.