SCHEMBL1218581

SCHEMBL1218581

Cc1cccc(P(c2cccc(C)c2)c2cccc(C)n2)c1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.41
CCR1 P32246 1/20 0.40
CCR8 P51685 1/20 0.40
GRM5 P41594 2/20 0.38
NOS3 P29474 1/20 0.38
NOS2 P35228 1/20 0.38
RAB9A P51151 2/20 0.36
GBA1 P04062 1/20 0.36
MAPT P10636 1/20 0.36
CYP1A2 P05177 2/20 0.35
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 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
SCHEMBL2463151 0.86 CCR1 (0.41) ACHECCR1CCR8GRM5NOS3
SCHEMBL231108 0.84 KDM4E (0.45) CCR1CCR8GRM5NOS3NOS2
SCHEMBL1219902 0.82 CCR1 (0.41) ACHECCR1CCR8GRM5NOS3
SCHEMBL28509210 0.82 KDM4E (0.44) CCR1CCR8GRM5NOS3NOS2
SCHEMBL955795 0.81 CCR1 (0.52) CCR1CCR8GRM5NOS3NOS2
SCHEMBL1217571 0.80 KDM4E (0.50) CCR1CCR8GRM5NOS3NOS2
SCHEMBL49786 0.76 ACHE (0.61) ACHEMAPTCYP1A2ALDH1A1MAPK1
SCHEMBL29415924 0.76 ACHE (0.61) ACHEMAPTCYP1A2ALDH1A1MAPK1
SCHEMBL1219479 0.76 KDM4E (0.60) ACHEGRM5RAB9ACYP1A2ALDH1A1
SCHEMBL1219260 0.76 TGFBR1 (0.41) ACHECCR1CCR8GRM5NOS3

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2256102-B1 PROCESS FOR PRODUCTION OF ALKOXYCARBONYL COMPOUND SUMITOMO CHEMICAL CO (JP) 2018-09-26 EP disclosed
EP-2828232-B1 PROCESS FOR PRODUCING ALKYL METHACRYLATE SUMITOMO CHEMICAL CO (JP) 2016-04-20 EP disclosed
EP-2828232-A1 PROCESS FOR PRODUCING ALKYL METHACRYLATE Sumitomo Chemical Company Limited (JP) 2015-01-28 EP disclosed
WO-2013141004-A1 PROCESS FOR PRODUCING ALKYL METHACRYLATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-09-26 WO disclosed
US-8399699-B2 Process for production of alkoxycarbonyl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-03-19 US disclosed
US-20110046417-A1 PROCESS FOR PRODUCTION OF ALKOXYCARBONYL COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-02-24 US disclosed
EP-2256102-A1 PROCESS FOR PRODUCTION OF ALKOXYCARBONYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2010-12-01 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 (1 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-20110046417-A1 PROCESS FOR PRODUCTION OF ALKOXYCARBONYL COMPOUND ADH1A, NAA50, NAA10 ACHE 2271/4885CCR1 3334/4885CCR8 2571/4885

“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.