SCHEMBL7970055

SCHEMBL7970055

COc1ccc2c(c1OC)/C(=C/c1ccccc1)c1ccccc1-2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
ALDH1A1 P00352 4/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
MAPT P10636 3/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
POLB P06746 1/20 0.43
NFE2L2 Q16236 1/20 0.42
TDP1 Q9NUW8 2/20 0.42
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41
TUBB2A Q13885 1/20 0.41

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
SCHEMBL7970058 1.00 SMN1; SMN2 (0.49) SMN1; SMN2NPC1RAB9AALDH1A1MEN1
SCHEMBL9181274 0.80 RAB9A (0.65) SMN1; SMN2NPC1RAB9AALDH1A1MEN1
SCHEMBL7970056 0.75 LMNA (0.47) MEN1KMT2AMAPTTUBB4ATUBB
SCHEMBL7970053 0.75 LMNA (0.47) MEN1KMT2AMAPTTUBB4ATUBB
SCHEMBL8726720 0.72 ALDH1A1 (0.50) SMN1; SMN2NPC1RAB9AALDH1A1MEN1
SCHEMBL7786089 0.72 RAB9A (0.87) SMN1; SMN2NPC1RAB9AALDH1A1MEN1
SCHEMBL3862633 0.71 RAB9A (0.58) SMN1; SMN2NPC1RAB9AALDH1A1MEN1
SCHEMBL283216 0.70 CYP19A1 (0.67) SMN1; SMN2ALDH1A1MEN1KMT2AMAPT
SCHEMBL7980263 0.68 CYP1A1 (0.50) SMN1; SMN2ALDH1A1MEN1KMT2AMAPT
SCHEMBL3643547 0.68 NPC1 (0.54) SMN1; SMN2NPC1RAB9AALDH1A1MEN1

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-6194439-B1 ANTICANCER AGENT PFIZER INC. 2001-02-27 US disclosed
EP-0586608-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER INC. (US) 1994-03-16 EP disclosed
WO-1992021660-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER, INC. (US) 1992-12-10 WO disclosed