SCHEMBL7638802

SCHEMBL7638802

COC(=O)C1C(C)C1(C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.40
CCR6 P51684 1/20 0.37
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 3/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.32
LMNA P02545 2/20 0.32
GAA P10253 1/20 0.32
HSD17B10 Q99714 1/20 0.32
POLA1 P09884 1/20 0.32
CHRNB2 P17787 2/20 0.31
CHRNA4 P43681 2/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA7 P36544 1/20 0.31
CYP1A2 P05177 1/20 0.31
HIF1A Q16665 1/20 0.31
ELANE P08246 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL2690897 0.83 HTT (0.35) ATMCCR6CYP2C19ALDH1A1HTT
SCHEMBL2690901 0.83 HTT (0.35) ATMCCR6CYP2C19ALDH1A1HTT
SCHEMBL2690895 0.83 HTT (0.35) ATMCCR6CYP2C19ALDH1A1HTT
SCHEMBL11794957 0.81 LMNA (0.31) ATMLMNA
SCHEMBL27811564 0.75 ALDH1A1 (0.35) ATMCCR6ALDH1A1HTTKMT2A
SCHEMBL10329694 0.75 PPM1B (0.35) ATMCCR6ALDH1A1HTTKMT2A
SCHEMBL1261691 0.75 PPM1B (0.35) ATMCCR6ALDH1A1HTTKMT2A
SCHEMBL10692865 0.75 PPM1B (0.35) ATMCCR6ALDH1A1HTTKMT2A
SCHEMBL14564578 0.75 ATM (0.32) ATMCYP2C19KMT2ACHRNB2CHRNA4
SCHEMBL14577914 0.73 CYP2C19 (0.33) ATMCYP2C19ALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6469198-B2 OBTAINED BY CONTACTING N-SALICYLIDENEAMINOALCOHOL WITH MONO OR DIVALENT COPPER COMPOUND; FORMATION OF OPTICALLY ACTIVE CYCLOPROPANE-CARBOXYLIC ESTER FROM PROCHIRAL OLEFIN AND DIAZOACETIC ACID ESTER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-10-22 US disclosed
US-20010037036-A1 Chiral copper complex catalyst composition and asymmetric production process using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-11-01 US disclosed
EP-1120401-A2 Chiral copper complex catalyst composition and asymmetric production process using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-08-01 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-20010037036-A1 Chiral copper complex catalyst composition and asymmetric production process using the same AP1M1, UBA3, AP1S1 ATM 4862/4885CCR6 824/4885CYP2C19 498/4885

“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.