SCHEMBL2964503

SCHEMBL2964503

[c]1c(-c2ccco2)ccc2c1Cc1ccccc1-2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 3/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
TP53 P04637 1/20 0.36
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 6/20 0.35
HPGD P15428 6/20 0.35
KDM4E B2RXH2 6/20 0.35
MAPT P10636 5/20 0.35
POLB P06746 5/20 0.35
HSD17B10 Q99714 4/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
TDP1 Q9NUW8 3/20 0.34
USP2 O75604 2/20 0.34
HTT P42858 1/20 0.34
TDP2 O95551 2/20 0.33
TSHR P16473 2/20 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
SCHEMBL2969178 0.77 ALDH1A1 (0.36) CASP1NPSR1SMN1; SMN2NPC1RAB9A
SCHEMBL216860 0.76 ALDH1A1 (0.38) SMN1; SMN2NPC1RAB9AALDH1A1HPGD
SCHEMBL2968618 0.75 ADRA1D (0.32) SMN1; SMN2NPC1RAB9AALDH1A1HPGD
SCHEMBL2965321 0.74 MAOB (0.43) SMN1; SMN2NPC1RAB9AALDH1A1HPGD
SCHEMBL2965677 0.73 ALDH1A1 (0.36) SMN1; SMN2NPC1RAB9AMAPK1ALDH1A1
SCHEMBL2974521 0.73 KDM4E (0.36) SMN1; SMN2NPC1RAB9AALDH1A1HPGD
SCHEMBL217877 0.73 ALDH1A1 (0.36) NPSR1SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL313500 0.73 PNMT (0.44) SMN1; SMN2NPC1RAB9AALDH1A1HPGD
SCHEMBL2974781 0.72 KDM4E (0.35) SMN1; SMN2NPC1RAB9AALDH1A1HPGD
SCHEMBL2965807 0.71 KDM4E (0.30) SMN1; SMN2NPC1RAB9AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US claimed
US-7763562-B2 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-07-27 US disclosed
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2007-06-14 US disclosed
US-7214747-B2 Phosphorus substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-05-08 US disclosed
US-7214746-B2 Phosphorus bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-05-08 US disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed
US-20050239981-A1 Phosphorus bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2005-10-27 US disclosed
US-20050239980-A1 Phosphorus substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2005-10-27 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 (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-20050239981-A1 Phosphorus bridged metallocene compounds for olefin polymerization PYM1, ZNF207, POLL CASP1 3829/4885NPSR1 2482/4885SMN1; SMN2 4049/4885
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization AP2M1, AP1M1, PYM1 CASP1 3466/4885NPSR1 2419/4885SMN1; SMN2 4156/4885
US-20050239980-A1 Phosphorus substituted metallocene compounds for olefin polymerization CCRL2, ARL1, OSBP2 CASP1 3816/4885NPSR1 2152/4885SMN1; SMN2 4055/4885

“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.