SCHEMBL21768464

SCHEMBL21768464

CC(C)(C)[Si](C)(C)OCc1nc2cnccc2n1Cc1cc(Cl)ccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 3/20 0.38
TP53 P04637 4/20 0.37
MAPT P10636 3/20 0.37
BRD4 O60885 1/20 0.36
GPR6 P46095 4/20 0.35
ALOX5AP P20292 1/20 0.34
PTAFR P25105 1/20 0.34

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
SCHEMBL18815809 0.80 TNF (0.41) TBXA2RTP53BRD4GPR6
SCHEMBL18815805 0.77 GALR3 (0.46) BRD4GPR6PTAFR
SCHEMBL18148898 0.77 MEN1 (0.45) TP53MAPTGPR6
Hydrochloric Acid SCHEMBL18815821 0.77 TBXA2R (0.41) TBXA2RTP53MAPT
SCHEMBL7832218 0.74 ATM (0.43) TP53MAPT
SCHEMBL18280252 0.71 TP53 (0.46) TP53MAPT
SCHEMBL18280253 0.71 TNF (0.41) TP53GPR6
SCHEMBL18918984 0.70 MEN1 (0.42) TBXA2RTP53MAPTBRD4GPR6
SCHEMBL13508622 0.70 KCNH2 (0.56) TBXA2RMAPT
SCHEMBL15552361 0.69 AAK1 (0.42) TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3080118-B1 TETRAHYDROIMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SRL (BE) 2020-03-04 EP disclosed