SCHEMBL3624738

SCHEMBL3624738

COC(=O)c1cc(C)[nH]n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.67
▸ HCAR2 Q8TDS4 2/20 0.62
▸ DAO P14920 1/20 0.62
▸ RAB9A P51151 4/20 0.51
▸ POLB P06746 2/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ LMNA P02545 2/20 0.51
▸ ALPL P05186 4/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ ABL1 P00519 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ CYP3A4 P08684 1/20 0.48
▸ ALPI P09923 1/20 0.48
▸ ALPG P10696 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ GAA P10253 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL1665229 0.81 DAO (0.58) MAPK1HCAR2DAOPOLBLMNA
SCHEMBL4490261 0.80 MAPK1 (0.67) MAPK1HCAR2DAORAB9APOLB
SCHEMBL68056 0.80 MAPK1 (1.00) MAPK1RAB9APOLBNPC1LMNA
SCHEMBL163583 0.80 MAPK1 (0.67) MAPK1HCAR2DAORAB9APOLB
SCHEMBL28835655 0.79 HCAR2 (0.66) MAPK1HCAR2RAB9APOLBNPC1
SCHEMBL30991269 0.79 MAPK1 (0.61) MAPK1HCAR2DAORAB9APOLB
SCHEMBL17376787 0.79 HCAR2 (0.62) MAPK1HCAR2DAORAB9APOLB
SCHEMBL28875184 0.79 HCAR2 (0.72) HCAR2DAORAB9ANPC1LMNA
SCHEMBL23013382 0.78 MAPK1 (0.65) MAPK1HCAR2RAB9APOLBNPC1
SCHEMBL1009738 0.78 MAPK1 (0.65) MAPK1HCAR2RAB9APOLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1535939-B1 Blocked polyisocyanate BAYER MATERIALSCIENCE LLC (US) 2008-05-21 — — EP claimed
US-20070149750-A1 Solid powder coating crosslinker BAYER MATERIALSCIENCE LLC 2007-06-28 — — US claimed
US-20050245718-A1 Solid powder coating crosslinker BAYER MATERIALSCIENCE LLC 2005-11-03 — — US claimed
EP-1535939-A1 Blocked polyisocyanate Bayer MaterialScience LLC (US) 2005-06-01 — — EP claimed
US-20050113550-A1 BLOCKED POLYISOCYANATE BAYER MATERIALSCIENCE LLC 2005-05-26 — — US claimed
US-20050113548-A1 Solid powder coating crosslinker BAYER MATERIALSCIENCE LLC 2005-05-26 — — US claimed
US-6894138-B1 Blocked polyisocyanate BAYER MATERIALSCIENCE LLC (US) 2005-05-17 — — US claimed
EP-0749448-B1 USE OF PYRAZOLE-BLOCKED POLYISOCYANATES IN ONE-COMPONENT CLEAR COATINGS ARCO CHEM TECH (US) 2001-05-30 — — EP claimed
EP-0749448-A1 ISOCYANATE-CROSSLINKED COATINGS HAVING REDUCED YELLOWING OLIN CORPORATION (US) 1996-12-27 — — EP claimed
EP-0749448-A4 ISOCYANATE-CROSSLINKED COATINGS HAVING REDUCED YELLOWING OLIN CORP (US) 1996-06-19 — — EP claimed
WO-1995006674-A1 ISOCYANATE-CROSSLINKED COATINGS HAVING REDUCED YELLOWING OLIN CORPORATION (US) 1995-03-09 — — WO claimed
EP-4746964-A1 NEW PYRAZOLOPYRIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2026-05-27 — — EP disclosed
WO-2026104690-A1 AQUEOUS DISPERSION OF A CROSSLINKING COMPONENT FOR CATIONIC PAINT BINDERS ALLNEX AUSTRIA GMBH (AT) 2026-05-21 — — WO disclosed
EP-3704094-B1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2026-03-11 — — EP disclosed
EP-4705308-A1 EGFR INHIBITORS FOR TREATING DISEASE Blossomhill Therapeutics, Inc. (US) 2026-03-11 — — EP disclosed
US-5352755-A Polyisocyanates blocked with pyrazole derivatives in mixture with active hydrogen-containing compounds; paints THE BAXENDEN CHEMICAL CO. (GB) 1994-10-04 — — US disclosed
US-5246557-A Wint pyrazoles; paints THE BAXENDEN CHEMICAL CO. (GB) 1993-09-21 — — US disclosed
EP-0159117-B1 BLOCKED ISOCYANATES THE BAXENDEN CHEMICAL COMPANY LIMITED (GB) 1993-01-27 — — EP disclosed
US-4976837-A PAINTS THE BAXENDEN CHEMICAL CO. (GB) 1990-12-11 — — US disclosed
EP-0159117-A1 Blocked isocyanates THE BAXENDEN CHEMICAL COMPANY LIMITED (GB) 1985-10-23 — — EP disclosed
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