SCHEMBL24258514

SCHEMBL24258514

C=C(OC(C)(C)C)N1CCCc2c(Cl)cc(-c3ccccc3C)cc2C1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 4/20 0.36
UCHL1 P09936 1/20 0.34
RIPK1 Q13546 3/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ESR2 Q92731 1/20 0.33
PLA2G7 Q13093 1/20 0.32
ABCB1 P08183 1/20 0.32
FTO Q9C0B1 1/20 0.32
AVPR1A P37288 1/20 0.31
MAPK1 P28482 1/20 0.30
NR1H2 P55055 1/20 0.30
CDK4 P11802 1/20 0.30
CCND1 P24385 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 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
SCHEMBL19657828 0.84 CREBBP (0.36) CREBBPRIPK1PLA2G7ABCB1FTO
SCHEMBL19657383 0.82 CREBBP (0.45) CREBBPRIPK1PLA2G7ABCB1FTO
SCHEMBL19657386 0.71 CREBBP (0.36) CREBBPRIPK1PLA2G7ABCB1CDK4
SCHEMBL24258501 0.70 CREBBP (0.53) CREBBPMEN1KMT2AABCB1GAA
SCHEMBL19644450 0.70 CREBBP (0.55) CREBBPUCHL1RIPK1MEN1KMT2A
SCHEMBL19657916 0.69 CREBBP (0.45) CREBBPRIPK1PLA2G7ABCB1CDK4
SCHEMBL19657381 0.69 CREBBP (0.56) CREBBPPLA2G7ABCB1CDK4CCND1
SCHEMBL19657776 0.69 CREBBP (0.44) CREBBPMEN1KMT2APLA2G7ABCB1
SCHEMBL19657387 0.68 CREBBP (0.54) CREBBPRIPK1PLA2G7
SCHEMBL19657912 0.67 CREBBP (0.41) CREBBPRIPK1PLA2G7ABCB1

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-3464270-B1 HETEROCYCLIC INHIBITORS OF CBP/EP300 AND THEIR USE IN THE TREATMENT OF CANCER GENENTECH INC (US) 2022-02-23 EP disclosed