SCHEMBL31018403

SCHEMBL31018403

FC(F)(F)c1ccc(Nc2cccc3c2CCNC3)cn1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 1/20 0.44
CD44 P16070 1/20 0.40
APP P05067 1/20 0.39
EPHX2 P34913 1/20 0.39
FAAH O00519 1/20 0.39
CSF1R P07333 1/20 0.38
CDK4 P11802 1/20 0.38
CDK6 Q00534 1/20 0.38
WEE1 P30291 1/20 0.37
P2RX7 Q99572 1/20 0.37
PIK3CD O00329 1/20 0.35
PIK3C2B O00750 1/20 0.35
MTOR P42345 1/20 0.35
ULK1 O75385 1/20 0.35
TEAD1 P28347 1/20 0.35
TEAD4 Q15561 1/20 0.35
TEAD2 Q15562 1/20 0.35
ABL1 P00519 1/20 0.35
BCR P11274 1/20 0.35

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
SCHEMBL31018417 0.81 TEAD1 (0.52) P2RY1CD44P2RX7PIK3CDPIK3C2B
Hydrochloric Acid SCHEMBL31018396 0.80 TEAD1 (0.51) P2RY1CD44P2RX7PIK3CDPIK3C2B
SCHEMBL31018391 0.76 CD44 (0.40) CD44CSF1RCDK4CDK6
SCHEMBL4868312 0.74 APP (0.41) APPEPHX2FAAHABL1BCR
SCHEMBL31018399 0.72 EPHX2 (0.40) APPEPHX2FAAHABL1BCR
SCHEMBL2847817 0.71 APP (0.41) APPEPHX2FAAHABL1BCR
SCHEMBL31018406 0.70 TEAD1 (0.51) EPHX2ULK1TEAD1TEAD4TEAD2
SCHEMBL31018386 0.70 ASIC3 (0.44) CD44CSF1RCDK4CDK6P2RX7
SCHEMBL31474532 0.68 EPHX2 (0.54) EPHX2
SCHEMBL30592023 0.68 EPHX2 (0.54) EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4654969-A1 COMPOUNDS AND METHODS FOR YAP/TEAD MODULATION AND INDICATIONS THEREFOR Opna Bio SA (CH) 2025-12-03 EP disclosed
WO-2024159067-A1 COMPOUNDS AND METHODS FOR YAP/TEAD MODULATION AND INDICATIONS THEREFOR Opna Bio SA (CH) 2024-08-02 WO disclosed