SCHEMBL23640233

SCHEMBL23640233

COc1cccc(OC2=CC(C)C(C)C=C2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
ACHE P22303 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CYP3A4 P08684 1/20 0.38
MEN1 O00255 1/20 0.38
BRCA1 P38398 1/20 0.38
HBB P68871 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.37
MTNR1A P48039 2/20 0.37
MTNR1B P49286 2/20 0.37
TAAR1 Q96RJ0 2/20 0.36
MGLL Q99685 1/20 0.36

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
SCHEMBL24302885 1.00 SMN1; SMN2 (0.44) SMN1; SMN2ACHEALDH1A1KDM4ECA1
SCHEMBL12656539 0.75 HAO1 (0.37) SMN1; SMN2ALDH1A1MEN1KMT2ANPC1
SCHEMBL23640439 0.75 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL24302883 0.75 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL11928883 0.74 MRGPRX2 (0.40) MAOB
SCHEMBL25015134 0.74 MRGPRX2 (0.40) MAOB
SCHEMBL13167638 0.72 SMN1; SMN2 (0.72) SMN1; SMN2ACHEALDH1A1KDM4ECA1
SCHEMBL29929943 0.72 SMN1; SMN2 (0.72) SMN1; SMN2ACHEALDH1A1KDM4ECA1
SCHEMBL30053231 0.72 SMN1; SMN2 (0.72) SMN1; SMN2ACHEALDH1A1KDM4ECA1
SCHEMBL1061713 0.72 SMN1; SMN2 (0.72) SMN1; SMN2ACHEALDH1A1KDM4ECA1

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-3848367-A1 TRICYCLIC COMPOUNDS ACTING ON CRBN PROTEINS Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2021-07-14 EP disclosed