SCHEMBL311527

SCHEMBL311527

NC1C2C=CC(C2)C1C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.65
CYP2C19 P33261 1/20 0.65
POLB P06746 5/20 0.50
TDP1 Q9NUW8 3/20 0.50
APEX1 P27695 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.43
GAA P10253 1/20 0.41
NPSR1 Q6W5P4 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
CASP6 P55212 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL1484126 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19POLBTDP1APEX1
SCHEMBL15529385 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19POLBTDP1APEX1
SCHEMBL2033299 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19POLBTDP1APEX1
SCHEMBL7232865 1.00 ALDH1A1 (0.65) ALDH1A1CYP2C19POLBTDP1APEX1
Hydrochloric Acid SCHEMBL26613189 0.98 ALDH1A1 (0.63) ALDH1A1CYP2C19POLBTDP1APEX1
Hydrochloric Acid SCHEMBL26613207 0.98 ALDH1A1 (0.63) ALDH1A1CYP2C19POLBTDP1APEX1
Hydrochloric Acid SCHEMBL19668549 0.98 ALDH1A1 (0.63) ALDH1A1CYP2C19POLBTDP1APEX1
Hydrochloric Acid SCHEMBL19668550 0.98 ALDH1A1 (0.63) ALDH1A1CYP2C19POLBTDP1APEX1
SCHEMBL24062391 0.83 POLB (0.70) ALDH1A1POLBTDP1APEX1SMN1; SMN2
SCHEMBL20346210 0.83 POLB (0.70) ALDH1A1POLBTDP1APEX1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117720452-A Preparation method of 3-aza-tricyclo [4.2.1.0 (2.5) ] nonane-7-ene-4-one 成都科圣原医药科技有限公司 2024-03-19 CN claimed
US-12534514-B2 Biological and synthetic molecules inhibiting respiratory syncytial virus infection Fraunhofer-Gesellschaft Zur Forderung Der Angewanditen Forschung (DE) 2026-01-27 US disclosed
CN-120202243-A Thermosetting resin composition, cured film, substrate, and electronic component 捷恩智株式会社 2025-06-24 CN disclosed
CN-119731211-A Cross-linked multispecific antibodies 恩拉扎治疗公司 2025-03-28 CN disclosed
CN-119136842-A Cyclodextrin complexes that specialize in resolution mediators 西蒂斯制药有限责任公司 2024-12-13 CN disclosed
WO-2024150597-A1 THERMOSETTING RESIN COMPOSITION, CURED FILM, SUBSTRATE, AND ELECTRONIC COMPONENT JNC株式会社 2024-07-18 WO disclosed
WO-2024130161-A2 NOVEL CAMPTOTHECIN DERIVATIVES AND CONJUGATES THEREOF BIONECURE THERAPEUTICS INC (US) 2024-06-20 WO disclosed
CN-117720452-A Preparation method of 3-aza-tricyclo [4.2.1.0 (2.5) ] nonane-7-ene-4-one 成都科圣原医药科技有限公司 2024-03-19 CN disclosed
CN-111902394-B Compositions and methods relating to salts of specific pro-inflammatory regressive mediators 西蒂斯制药有限责任公司 2024-03-08 CN disclosed
US-20240034753-A1 THERAPEUTIC PEPTIDES COHBAR, INC. 2024-02-01 US disclosed
EP-1516876-A1 Mediators of hedgehog signalling pathways, compositions and uses related thereto Curis, Inc. (US) 2005-03-23 EP disclosed
EP-1216234-B1 MEDIATORS OF HEDGEHOG SIGNALING PATHWAYS, COMPOSITIONS AND USES RELATED THERETO CURIS INC (US) 2004-12-29 EP disclosed
US-20030232846-A1 Caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED 2003-12-18 US disclosed
US-6545005-B1 Quinazolone derivatives CURTIS, INC. 2003-04-08 US disclosed
WO-2001019800-A9 MEDIATORS OF HEDGEHOG SIGNALING PATHWAYS, COMPOSITIONS AND USES RELATED THERETO CURIS INC (US) 2002-10-03 WO disclosed
EP-1244626-A2 CASPASE INHIBITORS AND USES THEREOF Vertex Pharmaceuticals Incorporated (US) 2002-10-02 EP disclosed
EP-1216234-A2 MEDIATORS OF HEDGEHOG SIGNALING PATHWAYS, COMPOSITIONS AND USES RELATED THERETO Curis, Inc. (US) 2002-06-26 EP disclosed
WO-2001042216-A2 CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED (US) 2001-06-14 WO disclosed
WO-2001019800-A2 MEDIATORS OF HEDGEHOG SIGNALING PATHWAYS, COMPOSITIONS AND USES RELATED THERETO CURIS, INC. (US) 2001-03-22 WO disclosed
EP-0557519-B1 PROCESS FOR PREPARING SULFONAMIDE DERIVATIVE OF NORBORNANE SHIONOGI & CO (JP) 1997-06-04 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 (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-12534514-B2 Biological and synthetic molecules inhibiting respiratory syncytial virus infection VIP, LNPEP, SARS1 ALDH1A1 4847/4885CYP2C19 4608/4885POLB 2124/4885
US-20030232846-A1 Caspase inhibitors and uses thereof CASP1, CASP3, CASP2 ALDH1A1 2618/4885CYP2C19 1368/4885POLB 4042/4885

“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.