SCHEMBL786337

SCHEMBL786337

CC(C)c1cc(C(C)C)[nH]n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.50
HCAR3 P49019 1/20 0.50
PRKAB2 O43741 5/20 0.38
PRKAG1 P54619 5/20 0.38
PRKAA2 P54646 5/20 0.38
PRKAA1 Q13131 5/20 0.38
PRKAG3 Q9UGI9 5/20 0.38
PRKAG2 Q9UGJ0 5/20 0.38
PRKAB1 Q9Y478 5/20 0.38
IGF1R P08069 3/20 0.37
MAPT P10636 6/20 0.37
TP53 P04637 5/20 0.37
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
CCNA1 P78396 1/20 0.37
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
POLB P06746 1/20 0.33
NPC1 O15118 1/20 0.33

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
Hydrochloric Acid SCHEMBL31389982 0.98 HCAR2 (0.48) HCAR2HCAR3PRKAB2PRKAG1PRKAA2
SCHEMBL20363473 0.84 HCAR2 (0.37) HCAR2HCAR3IGF1R
SCHEMBL17088570 0.84 HCAR2 (0.37) HCAR2HCAR3
SCHEMBL1206496 0.81 HCAR2 (0.43) HCAR2HCAR3PRKAB2PRKAG1PRKAA2
SCHEMBL18931220 0.79 HCAR2 (0.42) HCAR2HCAR3PRKAB2PRKAG1PRKAA2
SCHEMBL15831686 0.79 HCAR2 (0.38) HCAR2HCAR3IGF1R
SCHEMBL1531224 0.78
SCHEMBL26202951 0.78 HCAR2 (0.33) HCAR2HCAR3
SCHEMBL804646 0.75
SCHEMBL1628594 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117777322-B Biodegradable closed isocyanate chain extender, and preparation method and application thereof 浙江工业大学 2025-03-04 CN claimed
US-20240239944-A1 Production of a Blocked Curing Agent Based on a Partly Organic-Based Polyisocyanate and Use as a 1K PUR Baking Enamel COVESTRO DEUTSCHLAND AG (DE) 2024-07-18 US claimed
EP-4399234-A1 PRODUCTION OF A BLOCKED CURING AGENT BASED ON A PARTLY ORGANIC-BASED POLYISOCYANATE AND USE AS A 1K PUR BAKING ENAMEL Covestro Deutschland AG (DE) 2024-07-17 EP claimed
CN-117916281-A Production of blocked curing agents based on partially organic polyisocyanates and use as 1K PUR baking enamels 科思创德国股份有限公司 2024-04-19 CN claimed
CN-117777322-A Biodegradable closed isocyanate chain extender, and preparation method and application thereof 浙江工业大学 2024-03-29 CN claimed
CN-117777205-A Double-layer binuclear cis-trans-isomerism complex based on six-membered ring metal ligand induction, preparation method and application thereof 滨州学院 2024-03-29 CN claimed
WO-2023036861-A1 PRODUCTION OF A BLOCKED CURING AGENT BASED ON A PARTLY ORGANIC-BASED POLYISOCYANATE AND USE AS A 1K PUR BAKING ENAMEL COVESTRO DEUTSCHLAND AG (DE) 2023-03-16 WO claimed
EP-4148077-A1 PRODUCTION OF A BLOCKED CURING AGENT BASED ON A PARTIALLY BIO-BASED POLYISOCYANATE AND USE AS A 1K-PURE STOVING ENAMEL Covestro Deutschland AG (DE) 2023-03-15 EP claimed
CN-102888208-B Abrasive and substrate polishing method HITACHI CHEMICAL CO LTD 2015-02-25 CN claimed
US-20110045191-A1 MIXED-BLOCKED POLYISOCYANATES AND USES THEREOF JONES RICHARD GARFIELD 2011-02-24 US claimed
EP-1358242-B1 MIXED-BLOCKED POLYISOCYANATES AND USES THEREOF BAXENDEN CHEM (GB) 2006-03-15 EP claimed
US-20040067318-A1 Mixed-blocked polyisocyanates and uses thereof BAXENDEN CHEMICALS LIMITED (GB) 2004-04-08 US claimed
EP-1358242-A1 MIXED-BLOCKED POLYISOCYANATES AND USES THEREOF BAXENDEN CHEMICALS LIMITED (GB) 2003-11-05 EP claimed
WO-2002055577-A1 MIXED-BLOCKED POLYISOCYANATES AND USES THEREOF BAXENDEN CHEMICALS LIMITED (GB) 2002-07-18 WO claimed
US-12630742-B2 Polishing composition using polishing particles containing basic substance and having high water affinity NISSAN CHEMICAL CORPORATION (JP) 2026-05-19 US disclosed
US-20260117105-A1 POLISHING COMPOSITION HAVING EXCELLENT STORAGE STABILITY AND METHOD FOR PRODUCING SAME NISSAN CHEMICAL CORPORATION (JP) 2026-04-30 US disclosed
US-12552959-B2 Aqueous coating composition for corrosion protection ALLNEX AUSTRIA GMBH (AT) 2026-02-17 US disclosed
EP-1266911-A1 Catalyst for addition polymerization and process for producing an addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-18 EP disclosed
WO-2002055577-A1 MIXED-BLOCKED POLYISOCYANATES AND USES THEREOF BAXENDEN CHEMICALS LIMITED (GB) 2002-07-18 WO disclosed
WO-1996039409-A1 NITROSYLATED AND NITRATED SUPEROXIDE OXIDANTS AND REDUCTANTS NITROMED, INC. (US) 1996-12-12 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 (3 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-12552959-B2 Aqueous coating composition for corrosion protection ADH1A, ADH1C, TET1 HCAR2 2108/4885HCAR3 2828/4885PRKAB2 1947/4885
US-20260117105-A1 POLISHING COMPOSITION HAVING EXCELLENT STORAGE STABILITY AND METHOD FOR PRODUCING SAME SRPRA, SEM1, PSMA1 HCAR2 4689/4885HCAR3 4794/4885PRKAB2 1293/4885
US-12630742-B2 Polishing composition using polishing particles containing basic substance and having high water affinity POLR1A, PRMT1, SRRM2 HCAR2 4085/4885HCAR3 3725/4885PRKAB2 548/4885

“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.