SCHEMBL24782858

SCHEMBL24782858

CCN1CCC2(CC1)CC(F)(F)C2

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
CYP2D6 P10635 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 0.30
OPRK1 P41145 1/20 0.30

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
SCHEMBL25772761 0.87 TSHR (0.50) TSHRCYP2D6SMN1; SMN2
SCHEMBL1710042 0.80 KDM4E (0.37) TSHRCYP2D6SMN1; SMN2KDM4EGAA
SCHEMBL24235262 0.80 CYP2D6 (0.55) TSHRCYP2D6SMN1; SMN2
SCHEMBL23559996 0.80 TSHR (0.48) TSHRCYP2D6SMN1; SMN2KDM4EGAA
SCHEMBL6923193 0.78 TSHR (0.47) TSHRCYP2D6SMN1; SMN2KDM4EGAA
SCHEMBL26501920 0.76 TSHR (0.34) TSHR
SCHEMBL21106257 0.76 CYP2D6 (0.59) TSHRCYP2D6SMN1; SMN2
SCHEMBL27281812 0.75 CYP2D6 (0.46) TSHRCYP2D6SMN1; SMN2
SCHEMBL25772888 0.75 TSHR (0.36) TSHRKDM4EOPRM1
SCHEMBL21216356 0.74 KDM4E (0.34) TSHRSMN1; SMN2KDM4EGAAOPRM1

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
EP-4104861-A1 THERAPEUTIC AGENT FOR TAUOPATHIES Sumitomo Pharma Co., Ltd. (JP) 2022-12-21 EP disclosed