SCHEMBL24726641

SCHEMBL24726641

CC(C)c1cc(F)cc(-c2cccc(N(C)C)c2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.38
GBA1 P04062 2/20 0.38
FFAR1 O14842 1/20 0.38
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.37
TRPV3 Q8NET8 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
GFER P55789 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
IP6K1 Q92551 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 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
SCHEMBL26378150 0.83 RXRA (0.49) NOTUMFFAR1ALDH1A1TSHRKDM4E
SCHEMBL24726644 0.83 TAAR1 (0.50) FFAR1RXRARXRBRXRGTAAR1
SCHEMBL24726546 0.78 GBA1 (0.42) GBA1FFAR1ALDH1A1GRIN1GRIN2B
SCHEMBL12919968 0.78 FFAR1 (0.51) NOTUMFFAR1ALDH1A1TSHRKDM4E
SCHEMBL24910413 0.78 RXRA (0.50) ALDH1A1KDM4ETP53MAPTSMN1; SMN2
SCHEMBL20757465 0.78 TAAR1 (0.52) FFAR1RXRARXRBRXRGTAAR1
SCHEMBL27405271 0.78 RXRA (0.42) TSHRMAPTRXRARXRBRXRG
SCHEMBL30602821 0.75 ALDH1A1 (0.58) NOTUMFFAR1ALDH1A1TSHRKDM4E
SCHEMBL28926439 0.72 NOTUM (0.41) NOTUMFFAR1ALDH1A1TSHRKDM4E
SCHEMBL13119197 0.72 TAAR1 (0.53) ALDH1A1KDM4ETP53MAPTSMN1; SMN2

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-2022234965-A1 HETEROARYL DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT 주식회사 보로노이 2022-11-10 WO disclosed