SCHEMBL23640323

SCHEMBL23640323

O=c1cc(O)c2c(ccc3cc(F)ccc32)o1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 2/20 0.50
CA12 O43570 4/20 0.47
CA9 Q16790 4/20 0.47
CA1 P00915 2/20 0.47
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
PIM1 P11309 1/20 0.44
PGR P06401 2/20 0.43
MCL1 Q07820 2/20 0.41
GAA P10253 2/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
BCHE P06276 1/20 0.41
GLA P06280 1/20 0.41
CYP3A4 P08684 1/20 0.41
AKR1B1 P15121 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 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
SCHEMBL23640291 0.84 KDM4E (0.67) ALDH1A1KMT2AKDM4ECA12CA9
SCHEMBL2761833 0.82 ALDH1A1 (0.68) ALDH1A1KMT2AKDM4ECA12CA9
SCHEMBL29716542 0.82 ALDH1A1 (0.68) ALDH1A1KMT2AKDM4ECA12CA9
SCHEMBL23640303 0.81 ALDH1A1 (0.50) ALDH1A1KMT2AKDM4ECA12CA9
SCHEMBL23640512 0.81 PIM1 (0.64) ALDH1A1KMT2AKDM4ECA12CA9
SCHEMBL2761829 0.79 CA12 (0.66) ALDH1A1KMT2AKDM4ECA12CA9
SCHEMBL2492142 0.78 PIM1 (0.64) ALDH1A1KMT2AKDM4ECA12CA9
SCHEMBL31621885 0.78 PIM1 (0.64) ALDH1A1KMT2AKDM4ECA12CA9
SCHEMBL23640290 0.78 CYP2A6 (0.59) ALDH1A1KMT2AKDM4ECA12CA9
SCHEMBL23640312 0.78 ALDH1A1 (0.53) ALDH1A1KMT2AKDM4ECA12CA9

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