SCHEMBL27465865

SCHEMBL27465865

Cc1ccc(C2CC(c3ccc(Br)cc3)=NN2C(=O)CCl)cc1

nearest known ligand 0.88

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RNF114 Q9Y508 1/20 0.88
▸ YAP1 P46937 4/20 0.79
▸ TEAD4 Q15561 4/20 0.79
▸ MAPT P10636 1/20 0.64
▸ NPSR1 Q6W5P4 1/20 0.64
▸ TEAD2 Q15562 1/20 0.63
▸ MEN1 O00255 1/20 0.63
▸ NPC1 O15118 1/20 0.63
▸ RAB9A P51151 1/20 0.63
▸ KMT2A Q03164 1/20 0.63
▸ ACHE P22303 1/20 0.60
▸ MAOA P21397 1/20 0.59
▸ MAOB P27338 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.59

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
SCHEMBL23518678 0.89 RNF114 (0.91) RNF114YAP1TEAD4NPSR1MEN1
SCHEMBL30688878 0.88 RNF114 (0.88) RNF114YAP1TEAD4MAPTKMT2A
SCHEMBL25122626 0.88 RNF114 (0.83) RNF114YAP1TEAD4L3MBTL1
SCHEMBL16938347 0.86 MEN1 (0.68) RNF114YAP1TEAD4MAPTNPSR1
SCHEMBL23518782 0.85 RNF114 (0.78) RNF114YAP1TEAD4ACHEL3MBTL1
SCHEMBL28969681 0.79 RNF114 (0.70) RNF114YAP1TEAD4ACHEMAOA
SCHEMBL21392773 0.79 YAP1 (1.00) RNF114YAP1TEAD4MAPTKMT2A
SCHEMBL29129845 0.78 RNF114 (0.69) RNF114YAP1TEAD4ACHEL3MBTL1
SCHEMBL28969657 0.77 RNF114 (0.64) RNF114YAP1TEAD4NPSR1ACHE
SCHEMBL21392919 0.76 YAP1 (0.83) RNF114YAP1TEAD4MAPTNPSR1

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
WO-2024127022-A1 HETEROCYCLIC COMPOUNDS TARGETING THE NUDT5 PROTEIN OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2024-06-20 — — WO disclosed
Send feedback