SCHEMBL6173016

SCHEMBL6173016

Cc1ccc(C2=CC(Cl)=NN(Cl)N2)cc1

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ MAOB P27338 2/20 0.30
▸ METAP2 P50579 1/20 0.30
▸ METAP1 P53582 1/20 0.30
▸ NISCH Q9Y2I1 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
SCHEMBL6033866 0.71 — —
SCHEMBL9627571 0.67 ALDH1A1 (0.32) HPGDHSD17B10CYP2D6CYP2C9ALOX15
SCHEMBL21768546 0.66 KIF11 (0.37) HPGDHSD17B10ALOX15SMN1; SMN2KDM4E
SCHEMBL10399635 0.66 SMN1; SMN2 (0.35) HPGDHSD17B10CYP2C9CYP2C19SMN1; SMN2
SCHEMBL31538680 0.66 LMNA (0.39) SMN1; SMN2LMNAALDH1A1
SCHEMBL8054753 0.63 — —
SCHEMBL5488803 0.63 — —
SCHEMBL11584478 0.62 HAO1 (0.35) CYP2D6CYP2C9MEN1KMT2A
SCHEMBL21767983 0.62 KDM4E (0.35) HPGDCYP2C9CYP2C19SMN1; SMN2L3MBTL1
SCHEMBL8069261 0.60 — —

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-1126843-A4 COMPOUNDS DERIVED FROM AN AMINE NUCLEUS THAT ARE INHIBITORS OF IMPDH ENZYME BRISTOL MYERS SQUIBB CO (US) 2005-06-15 — — EP disclosed
US-6399773-B1 AUTOIMMUNE DISEASE; TRANSPLANTING ORGANS BRISTOL-MYERS SQUIBB CO. 2002-06-04 — — US disclosed
EP-1126843-A1 COMPOUNDS DERIVED FROM AN AMINE NUCLEUS THAT ARE INHIBITORS OF IMPDH ENZYME BRISTOL-MYERS SQUIBB COMPANY (US) 2001-08-29 — — EP disclosed
WO-2000025780-A1 COMPOUNDS DERIVED FROM AN AMINE NUCLEUS THAT ARE INHIBITORS OF IMPDH ENZYME BRISTOL-MYERS SQUIBB COMPANY (US) 2000-05-11 — — WO disclosed
Send feedback