SCHEMBL24754348

SCHEMBL24754348

CCC(C)c1cn(-c2cccc(C(C)C)c2)nn1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RXRA P19793 17/20 0.55
GRIN1 Q05586 17/20 0.55
GRIN2B Q13224 17/20 0.55
ESRRA P11474 1/20 0.48
FLT1 P17948 1/20 0.46
KDR P35968 1/20 0.46
TRPV1 Q8NER1 1/20 0.43

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
SCHEMBL25820296 0.87 RXRA (0.58) RXRAGRIN1GRIN2BESRRAFLT1
SCHEMBL25897473 0.82 BCHE (0.48) RXRAGRIN1GRIN2B
SCHEMBL16775726 0.80 RXRA (0.70) RXRAGRIN1GRIN2BESRRATRPV1
SCHEMBL25824836 0.78 RXRA (0.58) RXRAGRIN1GRIN2BESRRAFLT1
SCHEMBL20282459 0.76 RXRA (0.48) RXRAGRIN1GRIN2B
SCHEMBL19365355 0.76 RXRA (0.67) RXRAGRIN1GRIN2BESRRATRPV1
SCHEMBL19211451 0.76 RXRA (0.67) RXRAGRIN1GRIN2B
SCHEMBL20282458 0.76 RXRA (0.48) RXRAGRIN1GRIN2B
SCHEMBL25847222 0.75 RXRA (0.42) RXRAGRIN1GRIN2B
SCHEMBL22352192 0.74 RXRA (0.33) RXRAGRIN1GRIN2B

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-2022266248-A1 SOS1 PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC APPLICATIONS BIOTHERYX, INC. (US) 2022-12-22 WO disclosed