SCHEMBL24496010

SCHEMBL24496010

COc1ccc(CNS(=O)(=O)c2ccc(NCc3ccc(C(F)(F)F)cc3)c(Br)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
PKM P14618 1/20 0.49
CYP19A1 P11511 2/20 0.48
TSHR P16473 2/20 0.47
HTT P42858 2/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 1/20 0.47
BMP1 P13497 1/20 0.47
ACP1 P24666 1/20 0.46
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA9 Q16790 2/20 0.45
MAPT P10636 2/20 0.45
KMT2A Q03164 1/20 0.45
GAA P10253 1/20 0.45
RECQL P46063 1/20 0.45

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
SCHEMBL24496068 0.86 CYP19A1 (0.47) ALDH1A1PKMCYP19A1HTTLMNA
SCHEMBL29648307 0.86 CYP19A1 (0.47) ALDH1A1PKMCYP19A1HTTLMNA
SCHEMBL25801783 0.84 TEAD1 (0.46) ALDH1A1CYP19A1KDM4ECA12CA1
SCHEMBL29648341 0.84 CYP19A1 (0.47) CYP19A1KDM4ECA12CA1CA2
SCHEMBL24496161 0.84 CYP19A1 (0.47) CYP19A1KDM4ECA12CA1CA2
SCHEMBL24496152 0.82 CNR2 (0.47) CYP19A1CA1CA2CA9KMT2A
SCHEMBL29648404 0.82 CYP19A1 (0.45) ALDH1A1PKMCYP19A1HTTLMNA
SCHEMBL24496309 0.82 CYP19A1 (0.45) ALDH1A1PKMCYP19A1HTTLMNA
SCHEMBL29648304 0.82 BMP1 (0.51) BMP1ACP1CA12CA1CA2
SCHEMBL26669290 0.82 BMP1 (0.51) BMP1ACP1CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022120355-A1 TEAD DEGRADERS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-06-09 WO disclosed
WO-2022120353-A1 TEAD INHIBITORS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-06-09 WO disclosed
WO-2022120355-A1 TEAD DEGRADERS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-06-09 WO disclosed
WO-2022120353-A1 TEAD INHIBITORS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-06-09 WO disclosed