SCHEMBL24016281

SCHEMBL24016281

Cn1cc2c3cc(NC(=O)c4cccnc4)ccc3n(-c3ccc(C(F)(F)F)cc3)c2n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 1/20 0.61
TEAD4 Q15561 1/20 0.61
TEAD2 Q15562 1/20 0.61
TEAD3 Q99594 1/20 0.61
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
TSHR P16473 1/20 0.51
EPHX2 P34913 5/20 0.48
CSF1R P07333 3/20 0.48
BRAF P15056 3/20 0.48
RXFP1 Q9HBX9 1/20 0.47
LMNA P02545 3/20 0.46
MAPT P10636 2/20 0.46
TP53 P04637 1/20 0.46
TRPA1 O75762 1/20 0.46
ABL1 P00519 2/20 0.46
BCR P11274 2/20 0.46
KDM4E B2RXH2 1/20 0.45
POLB P06746 1/20 0.45
KHK P50053 1/20 0.44

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
SCHEMBL24016137 0.84 TEAD1 (0.60) TEAD1TEAD4TEAD2TEAD3BRAF
SCHEMBL24016573 0.83 TEAD1 (0.69) TEAD1TEAD4TEAD2TEAD3BRAF
SCHEMBL24015693 0.81 TEAD1 (0.66) TEAD1TEAD4TEAD2TEAD3LMNA
SCHEMBL24016185 0.81 TEAD1 (0.63) TEAD1TEAD4TEAD2TEAD3MEN1
SCHEMBL24015646 0.80 TEAD1 (0.64) TEAD1TEAD4TEAD2TEAD3LMNA
SCHEMBL24015665 0.80 TEAD1 (0.64) TEAD1TEAD4TEAD2TEAD3MEN1
SCHEMBL30055916 0.80 TEAD1 (0.64) TEAD1TEAD4TEAD2TEAD3LMNA
SCHEMBL24016542 0.80 TEAD1 (0.64) TEAD1TEAD4TEAD2TEAD3MEN1
SCHEMBL24015783 0.80 TEAD1 (0.64) TEAD1TEAD4TEAD2TEAD3EGFR
SCHEMBL24016138 0.79 TEAD1 (0.63) TEAD1TEAD4TEAD2TEAD3MEN1

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-2021224291-A1 TRICYCLIC HETEROCYCLES USEFUL AS TEAD BINDERS MERCK PATENT GMBH (DE) 2021-11-11 WO disclosed