SCHEMBL508463

SCHEMBL508463

CCO/C=C(\C#N)C(=O)OCC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.61
ALDH1A1 P00352 7/20 0.50
TSHR P16473 1/20 0.50
MAPT P10636 7/20 0.48
KDM4E B2RXH2 2/20 0.48
POLB P06746 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
PTP4A1 Q93096 1/20 0.48
MIF P14174 1/20 0.48
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
NPSR1 Q6W5P4 3/20 0.47
USP2 O75604 2/20 0.47
GAA P10253 2/20 0.47
PDCD1 Q15116 1/20 0.46
CD274 Q9NZQ7 1/20 0.46
PKM P14618 1/20 0.46

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
SCHEMBL167036 1.00 CYP2C9 (0.61) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL167037 1.00 CYP2C9 (0.61) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL11652941 0.87 CYP2C9 (0.47) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL11652946 0.87 CYP2C9 (0.47) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL11106211 0.87 CYP2C9 (0.56) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL31636860 0.85 CYP2C9 (0.61) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL2671868 0.85 CYP2C9 (0.43) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL2671866 0.85 CYP2C9 (0.43) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL4546680 0.85 CYP2C9 (0.61) CYP2C9ALDH1A1TSHRMAPTKDM4E
SCHEMBL4135128 0.85 CYP2C9 (0.61) CYP2C9ALDH1A1TSHRMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4737449-A1 P53-Y220C SELECTIVE SMALL-MOLECULAR REACTIVATOR COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF Changchun Genescience Pharmaceutical Co., Ltd. (CN) 2026-05-06 EP disclosed
US-20260042765-A1 PYRROLOTRIAZINE COMPOUNDS AS TAM INHIBITORS INCYTE CORP (US) 2026-02-12 US disclosed
US-20260027096-A1 PHD INHIBITORS UNIV OXFORD INNOVATION LTD (GB) 2026-01-29 US disclosed
EP-4655069-A1 PYRIDAZINES AS SARM1 INHIBITORS Disarm Therapeutics, Inc. (US) 2025-12-03 EP disclosed
EP-4655288-A1 PHD INHIBITORS Oxford University Innovation Limited (GB) 2025-12-03 EP disclosed
EP-4655294-A1 PYRAZOLE DERIVSTIVES AS PHD INHIBITORS Oxford University Innovation Limited (GB) 2025-12-03 EP disclosed
US-12486234-B2 PAPD5 inhibitors and methods of use thereof CHILDREN'S MEDICAL CENTER CORPORATION (US) 2025-12-02 US disclosed
US-20250333424-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2025-10-30 US disclosed
WO-2025217420-A1 PYRIDINONE COMPOUNDS, METHODS AND USES THEREOF ZENO MANAGEMENT, INC. (US) 2025-10-16 WO disclosed
EP-3727380-B1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA MERCK SHARP & DOHME LLC (US) 2025-09-24 EP disclosed
US-5849779-A Pyrazole derivatives and their pharmaceutical use JAPAN ENERGY CORPORATION (JP) 1998-12-15 US disclosed
EP-0810217-A1 Pyrazole derivatives and their pharmaceutical use as smooth muscle cell growth inhibitors JAPAN ENERGY CORPORATION (JP) 1997-12-03 EP disclosed
EP-0450073-B1 1-AZAINDOLIZINE DERIVATIVE, INTERMEDIATE FOR SYNTHESIS THEREOF, AND ANTIALLERGIC CONTAINING 1-AZAINDOLIZINE DERIVATIVE ZENYAKU KOGYO KK (JP) 1995-03-08 EP disclosed
US-5112833-A Dermatitis, rhinitis, asthma ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 1992-05-12 US disclosed
EP-0450073-A1 1-AZAINDOLIZINE DERIVATIVE, INTERMEDIATE FOR SYNTHESIS THEREOF, AND ANTIALLERGIC CONTAINING 1-AZAINDOLIZINE DERIVATIVE ZENYAKU KOGYO KABUSHIKIKAISHA (JP) 1991-10-09 EP disclosed
US-RE30024-E ANTIALLERGENS STERLING DRUG INC. (US) 1979-06-05 US disclosed
US-4118571-A ANTIALLERGENS STERLING DRUG INC. (US) 1978-10-03 US disclosed
US-4086233-A ANTIALLERGENS STERLING DRUG INC. (US) 1978-04-25 US disclosed
US-4032523-A ANTIALLERGENS STERLING DRUG INC. (US) 1977-06-28 US disclosed
US-4018770-A ANTIALLERGENS STERLING DRUG INC. (US) 1977-04-19 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 (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-20260027096-A1 PHD INHIBITORS HIF1AN, HIF1A, EGLN1 CYP2C9 1396/4885ALDH1A1 113/4885TSHR 4487/4885
US-20260042765-A1 PYRROLOTRIAZINE COMPOUNDS AS TAM INHIBITORS MAP2K2, TTK, MAP2K5 CYP2C9 2993/4885ALDH1A1 2069/4885TSHR 467/4885
US-12486234-B2 PAPD5 inhibitors and methods of use thereof POT1, PARP15, TERT CYP2C9 4754/4885ALDH1A1 2425/4885TSHR 3815/4885
US-20250333424-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, IRF3 CYP2C9 2850/4885ALDH1A1 3515/4885TSHR 4788/4885

“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.