SCHEMBL30468765

SCHEMBL30468765

CC(=O)c1ccc(N)c(Br)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.52
CREBBP Q92793 1/20 0.47
CA2 P00918 2/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 5/20 0.42
MAPK1 P28482 2/20 0.42
HTT P42858 1/20 0.42
CYP2A6 P11509 1/20 0.41
ALDH1A1 P00352 2/20 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
SCHEMBL842236 1.00 PRKCI (0.52) PRKCICREBBPCA2CA12CA1
SCHEMBL7109894 0.83 PRKCI (0.56) PRKCICREBBPCA2NPC1RAB9A
SCHEMBL1376911 0.83 ALDH1A1 (0.52) CA2CA12CA1CA4CA6
SCHEMBL1008508 0.81 CDC25B (0.55) CA2CA12CA1CA4CA6
SCHEMBL30508415 0.81 PRKCI (0.53) PRKCICREBBPNPC1RAB9ASMN1; SMN2
SCHEMBL3090722 0.81 PARP1 (0.50) CA2CA12CA1CA4CA6
SCHEMBL1026788 0.81 PRKCI (0.53) PRKCICREBBPNPC1RAB9ASMN1; SMN2
SCHEMBL265937 0.80 PRKCI (0.62) PRKCICREBBPNPC1RAB9AMAPT
SCHEMBL3022646 0.80 MAPT (0.47) PRKCINPC1RAB9ASMN1; SMN2MAPT
SCHEMBL31495791 0.80 PRKCI (0.62) PRKCICREBBPNPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4558485-A1 TEAD INHIBITORS AND METHODS OF USE Sporos Biodiscovery, Inc. (US) 2025-05-28 EP disclosed
CN-119497708-A TEAD inhibitors and methods of use 思博睿生物探索公司 2025-02-21 CN disclosed
WO-2024020350-A1 TEAD INHIBITORS AND METHODS OF USE SPOROS BIODISCOVERY, INC. (US) 2024-01-25 WO disclosed
WO-2023161841-A1 CHIRAL (P, N)-LIGAND FOR METAL COMPLEXES AND METHOD OF PREPARATION THEREOF Indian Institute Of Science Education And Research Bhopal (IN) 2023-08-31 WO disclosed
CN-113845548-B Platinum complex of quinazoline hydrazine dithioformate and preparation method and application thereof 深圳大学 2023-06-06 CN disclosed