SCHEMBL2963223

SCHEMBL2963223

CC1=C(c2cccc3ccccc23)c2c(Br)cccc2C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.36
HTR7 P34969 3/20 0.35
HTR1A P08908 2/20 0.35
ALDH1A1 P00352 3/20 0.34
CYP2A6 P11509 1/20 0.34
BRD4 O60885 1/20 0.33
KDM4E B2RXH2 5/20 0.33
HPGD P15428 2/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GSK3B P49841 1/20 0.33
ADK P55263 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
ENPP3 O14638 1/20 0.32
ENPP1 P22413 1/20 0.32
NISCH Q9Y2I1 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C19 P33261 2/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL2963720 0.79 ALDH1A1 (0.36) DHFRHTR7HTR1AALDH1A1CYP2A6
SCHEMBL2959111 0.79 ALDH1A1 (0.34) ALDH1A1MAOAMAOB
SCHEMBL2969356 0.76 FABP4 (0.36) ALDH1A1
SCHEMBL2964720 0.75 CA1 (0.43) DHFRALDH1A1CYP2A6GSK3BGPR55
SCHEMBL2970226 0.75 TDP1 (0.38) DHFRALDH1A1CYP2A6KDM4EGPR55
SCHEMBL2960711 0.72 NPC1 (0.33) ALDH1A1KDM4EHPGDHSD17B10CYP2C19
SCHEMBL2967198 0.71 RAPGEF4 (0.32) ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL29732516 0.70 HTR7 (0.43) DHFRHTR7HTR1AALDH1A1CYP2A6
SCHEMBL2971063 0.70 ALDH1A1 (0.34) ALDH1A1HSD17B10CYP3A4
SCHEMBL2959344 0.70 PTPN1 (0.37) DHFRHTR7HTR1AALDH1A1KDM4E

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-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
WO-2006065809-A2 HETEROATOM BRIDGED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-06-22 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 (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 DHFR 3591/4885HTR7 2417/4885HTR1A 2170/4885

“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.