SCHEMBL2544949

SCHEMBL2544949

OCCCCC1CCNCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 3/20 0.41
ITGA2B P08514 3/20 0.41
HRH3 Q9Y5N1 2/20 0.41
NAMPT P43490 1/20 0.39
FAAH O00519 1/20 0.38
GBA1 P04062 3/20 0.38
GNAO1 P09471 3/20 0.37
SLC6A4 P31645 1/20 0.37
TPSAB1 Q15661 1/20 0.36
TPSD1 Q9BZJ3 1/20 0.36
TPSG1 Q9NRR2 1/20 0.36
GNAI3 P08754 2/20 0.36
GNAI1 P63096 2/20 0.36
SLC6A1 P30531 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRB2 P47870 2/20 0.34
SLC6A12 P48065 2/20 0.34
SLC6A11 P48066 2/20 0.34
SLC6A13 Q9NSD5 2/20 0.34
GABRA1 P14867 1/20 0.34

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
SCHEMBL11261846 0.98 ITGB3 (0.40) ITGB3ITGA2BHRH3NAMPTFAAH
SCHEMBL1838111 0.98 ITGB3 (0.40) ITGB3ITGA2BHRH3NAMPTFAAH
Hydrochloric Acid SCHEMBL1844095 0.98 ITGB3 (0.40) ITGB3ITGA2BHRH3NAMPTFAAH
Hydrochloric Acid SCHEMBL31752969 0.96 GNAO1 (0.42) ITGB3ITGA2BHRH3NAMPTFAAH
Hydrochloric Acid SCHEMBL7419436 0.96 GNAO1 (0.42) ITGB3ITGA2BHRH3NAMPTFAAH
SCHEMBL28893 0.93 ITGB3 (0.42) ITGB3ITGA2BHRH3NAMPTFAAH
Hydrochloric Acid SCHEMBL146163 0.91 ITGB3 (0.41) ITGB3ITGA2BHRH3NAMPTFAAH
Bromide SCHEMBL11261498 0.91 ITGB3 (0.41) ITGB3ITGA2BHRH3NAMPTFAAH
SCHEMBL331124 0.87 HRH3 (0.47) ITGB3ITGA2BHRH3NAMPTFAAH
SCHEMBL4654559 0.86 SLC6A1 (0.45) ITGB3ITGA2BHRH3NAMPTGBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4720058-A2 BIFUNCTIONAL DEGRADERS AND USES THEREOF Casma Therapeutics, Inc. (US) 2026-04-08 EP disclosed
US-12558428-B2 Heterobifunctional compounds and their use in treating disease HALDA THERAPEUTICS OPCO, INC. (US) 2026-02-24 US disclosed
US-20250281623-A1 HETEROBIFUNCTIONAL COMPOUNDS AND THEIR USE IN TREATING DISEASE HALDA THERAPEUTICS OPCO, INC. 2025-09-11 US disclosed
EP-4606803-A1 KRAS G12D DEGRADATION AGENT, AND PREPARATION METHOD AND USE THEREFOR Leadingtac Pharmaceutical (Shaoxing) Co., Ltd. (CN) 2025-08-27 EP disclosed
WO-2025109097-A2 NOVEL NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND USES THEREOF HEIDELBERG PHARMA RESEARCH GMBH (DE) 2025-05-30 WO disclosed
US-20250171419-A1 NOVEL NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND USES THEREOF HEIDELBERG PHARMA RESEARCH GMBH (DE) 2025-05-29 US disclosed
CN-119948027-A SOS1 protein degradation agent and application thereof 领泰生物医药(绍兴)有限公司 2025-05-06 CN disclosed
US-12215099-B2 Quinolinone and benzoxazine derivatives as muscarinic M1 and/or M4 receptor agonists NXERA PHARMA UK LIMITED (GB) 2025-02-04 US disclosed
WO-2024249291-A2 BIFUNCTIONAL DEGRADERS AND USES THEREOF CASMA THERAPEUTICS, INC. (US) 2024-12-05 WO disclosed
EP-4466260-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER Astrazeneca AB (SE) 2024-11-27 EP disclosed
WO-2009024825-A1 2-PYRAZINYLBENZIMIDAZOLE DERIVATIVES AS RECEPTOR TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2009-02-26 WO disclosed
WO-2008097428-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2008-08-14 WO disclosed
EP-1382603-B1 NITROGENOUS FUSED-RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF EISAI R&D MAN CO LTD (JP) 2008-07-23 EP disclosed
US-20070088044-A1 Quinazoline derivatives as antitumor agents ASTRAZENECA AB 2007-04-19 US disclosed
US-7074801-B1 Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof EISAI CO., LTD. (JP) 2006-07-11 US disclosed
EP-1444211-A2 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS AstraZeneca AB (SE) 2004-08-11 EP disclosed
EP-1382603-A1 NITROGENOUS FUSED−RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF Eisai Co., Ltd. (JP) 2004-01-21 EP disclosed
WO-2003040109-A2 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ASTRAZENECA AB (SE) 2003-05-15 WO disclosed
US-4345071-A AZIDOALKYL-HETEROCYCLIC AMIDINE INTERMEDIATES LEO PHARMACEUTICAL PRODUCTS, LTD. A/S (DK) 1982-08-17 US disclosed
US-4229443-A Derivatives of penicillanic acid LEO PHARMACEUTICAL PRODUCTS, LTD. A/S (DK) 1980-10-21 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 (5 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-20070088044-A1 Quinazoline derivatives as antitumor agents ERBB2, EGFR, ERBB4 ITGB3 2869/4885ITGA2B 3717/4885HRH3 1200/4885
US-12215099-B2 Quinolinone and benzoxazine derivatives as muscarinic M1 and/or M4 receptor agonists CHRM1, CHRM4, CHRM2 ITGB3 2863/4885ITGA2B 2873/4885HRH3 94/4885
US-12558428-B2 Heterobifunctional compounds and their use in treating disease BRCA1, H1-0, FOXM1 ITGB3 116/4885ITGA2B 88/4885HRH3 1576/4885
US-20250281623-A1 HETEROBIFUNCTIONAL COMPOUNDS AND THEIR USE IN TREATING DISEASE VHL, HMBS, BRCA1 ITGB3 699/4885ITGA2B 458/4885HRH3 2421/4885
US-20250171419-A1 NOVEL NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND USES THEREOF NAMPT, NAPRT, NNMT ITGB3 835/4885ITGA2B 479/4885HRH3 2488/4885

“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.