SCHEMBL2959178

SCHEMBL2959178

BrCc1ccccc1-c1[c]c2c(cc1)-c1ccccc1C2

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.37
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAOA P21397 1/20 0.31
SRD5A2 P31213 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
SCHEMBL217598 0.85 PNMT (0.37) PNMTCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL217921 0.82 PNMT (0.36) PNMTCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL2965677 0.80 ALDH1A1 (0.36) PNMTCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL2974982 0.78 NPC1 (0.37) PNMTCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL217877 0.76 ALDH1A1 (0.36) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL2974521 0.76 KDM4E (0.36) PNMTCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL313500 0.76 PNMT (0.44) PNMTCYP1A2CYP3A4KDM4ENPC1
SCHEMBL2964850 0.76 CYP1A2 (0.34) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL2974302 0.76 KDM4E (0.33) PNMTKDM4ENPC1ALDH1A1LMNA
SCHEMBL216860 0.76 ALDH1A1 (0.38) PNMTCYP1A2CYP3A4CYP2C19KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7763562-B2 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-07-27 US disclosed
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2007-06-14 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 (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-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization AP2M1, AP1M1, PYM1 PNMT 2021/4885CYP1A2 2409/4885CYP3A4 1385/4885

“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.