SCHEMBL5602334

SCHEMBL5602334

Cc1ccccc1CC1=c2ccccc2=C[P]1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.36
HPGD P15428 2/20 0.33
AR P10275 1/20 0.33
CTBP2 P56545 1/20 0.33
ACHE P22303 1/20 0.33
P2RX7 Q99572 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TYMP P19971 1/20 0.32
CHRM2 P08172 1/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
LTA4H P09960 1/20 0.31
KMT2A Q03164 1/20 0.31
HTT P42858 1/20 0.30
DAO P14920 1/20 0.30
CYP2A13 Q16696 1/20 0.30
USP2 O75604 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
SCHEMBL2090458 0.70 TAAR1 (0.56) TAAR1HPGDARACHEP2RX7
SCHEMBL29477327 0.70 TAAR1 (0.56) TAAR1HPGDARACHEP2RX7
SCHEMBL5602511 0.68 LIPG (0.30)
SCHEMBL29772212 0.68 TAAR1 (0.54) TAAR1HPGDARACHEP2RX7
SCHEMBL11200954 0.68 TAAR1 (0.54) TAAR1HPGDARACHEP2RX7
SCHEMBL5601409 0.67 TAAR1 (0.37) TAAR1HPGDARCTBP2ACHE
SCHEMBL8095627 0.66 LTA4H (0.53) TAAR1ARACHECHRM2PTGS1
SCHEMBL9741301 0.64 CALM1 (0.55) TAAR1ACHEP2RX7ALDH1A1LTA4H
SCHEMBL275838 0.64 CALM1 (0.55) TAAR1ACHEP2RX7ALDH1A1LTA4H
SCHEMBL29940610 0.64 CALM1 (0.55) TAAR1ACHEP2RX7ALDH1A1LTA4H

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-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US claimed
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed