SCHEMBL21526166

SCHEMBL21526166

CC(C)C[C@H](NC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12)C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.61
CYP3A4 P08684 2/20 0.61
CYP2C9 P11712 2/20 0.61
CYP2D6 P10635 1/20 0.61
TSHR P16473 1/20 0.61
PMP22 Q01453 1/20 0.61
HIF1A Q16665 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
CNR1 P21554 7/20 0.51
CNR2 P34972 6/20 0.49
PTGER4 P35408 2/20 0.43
LMNA P02545 1/20 0.42
CYP2C19 P33261 1/20 0.42
CFD P00746 2/20 0.40

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
SCHEMBL21526167 1.00 CYP1A2 (0.61) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21526168 0.92 CYP1A2 (0.65) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21526169 0.92 CYP1A2 (0.65) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21526173 0.90 CYP1A2 (0.60) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21526174 0.90 CYP1A2 (0.60) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL31016972 0.90 CYP1A2 (0.60) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21526163 0.87 CNR1 (0.67) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21526162 0.87 CNR1 (0.67) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL23055696 0.86 CYP1A2 (0.71) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21526170 0.84 CNR1 (0.63) CYP1A2CYP3A4CYP2C9CYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3564214-A1 INDAZOLE DERIVATIVES AS MODULATORS OF THE CANNABINOID SYSTEM Universita' Degli Studi G. D Annunzio Chieti - Pescara (IT) 2019-11-06 EP claimed
EP-3564214-B1 INDAZOLE DERIVATIVES AS MODULATORS OF THE CANNABINOID SYSTEM UNIV DEGLI STUDI G DANNUNZIO CHIETI PESCARA (IT) 2024-07-03 EP disclosed
EP-3564214-A1 INDAZOLE DERIVATIVES AS MODULATORS OF THE CANNABINOID SYSTEM Universita' Degli Studi G. D Annunzio Chieti - Pescara (IT) 2019-11-06 EP disclosed
EP-3564214-A1 INDAZOLE DERIVATIVES AS MODULATORS OF THE CANNABINOID SYSTEM Universita' Degli Studi G. D Annunzio Chieti - Pescara (IT) 2019-11-06 EP disclosed