SCHEMBL8575116

SCHEMBL8575116

COC(CNc1ccc(C#N)cc1)OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.40
ABCC9 O60706 3/20 0.40
KCNJ11 Q14654 3/20 0.40
MMP2 P08253 1/20 0.39
CYP2A6 P11509 2/20 0.38
CACNA1B Q00975 1/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 3/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
MAPT P10636 2/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
SAE1 Q9UBE0 1/20 0.37
UBA2 Q9UBT2 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
PKM P14618 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL7395153 0.83 GAA (0.41) LOXL2ABCC9KCNJ11MMP2CYP2A6
SCHEMBL18412373 0.79 LOXL2 (0.44) LOXL2ABCC9KCNJ11MMP2CYP2A6
SCHEMBL7274127 0.79 GRIA1 (0.39) LOXL2ABCC9KCNJ11MMP2CYP2A6
Ammonia Solution, Strong SCHEMBL6699439 0.78 LOXL2 (0.42) LOXL2ABCC9KCNJ11MMP2CYP2A6
SCHEMBL7275456 0.76 ABCC9 (0.44) LOXL2ABCC9KCNJ11MMP2CYP2A6
SCHEMBL19057160 0.76 CA1 (0.42) LOXL2ABCC9KCNJ11MMP2CYP2A6
SCHEMBL4147798 0.76 MAPT (0.37) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL241292 0.76 MAPT (0.41) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL1728733 0.76 CA1 (0.47) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL18235945 0.76 EGLN2 (0.50) LOXL2ABCC9KCNJ11MMP2CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025072637-A1 OXYGENATED HETEROCYCLIC LSD-1 INHIBITORS AND RELATED METHODS OF USE THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2025-04-03 WO disclosed
US-5852192-A Cyclic urea derivatives, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1998-12-22 US disclosed