SCHEMBL19981573

SCHEMBL19981573

Cc1cc2c(s1)CC(C)(C)C2O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
PNMT P11086 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
SCHEMBL19981580 0.78 MEN1 (0.31) MEN1TSHRCYP2C19RAB9AKMT2A
SCHEMBL19981578 0.78 MEN1 (0.31) MEN1TSHRCYP2C19RAB9AKMT2A
SCHEMBL12024873 0.77 CYP11B1 (0.30)
SCHEMBL12045180 0.77 KCNH2 (0.35) TSHRRAB9A
SCHEMBL12086601 0.77 SMN1; SMN2 (0.30)
SCHEMBL11931745 0.73 ALDH1A1 (0.31) MEN1CYP2C19KMT2A
SCHEMBL12044716 0.73
SCHEMBL19981716 0.65 UGT2B17 (0.38) MEN1TSHRCYP2C19RAB9AKMT2A
SCHEMBL2921714 0.64 PNMT (0.31) PNMT
SCHEMBL13303498 0.63 UGT2B17 (0.47) MEN1TSHRCYP2C19RAB9AKMT2A

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-2365970-B1 PYRIDAZINONES AND THEIR USE AS BTK INHIBITORS GILEAD CONNECTICUT INC (US) 2018-03-21 EP disclosed