SCHEMBL31387362

SCHEMBL31387362

N#CN1CCC2(CC1)OCCc1ccsc12

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.51
OPRL1 P41146 6/20 0.43
TAAR1 Q96RJ0 1/20 0.40
SIGMAR1 Q99720 2/20 0.38
OTUD7B Q6GQQ9 1/20 0.37

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
SCHEMBL31252999 0.77 RORC (0.51) RORCOPRL1TAAR1SIGMAR1
SCHEMBL31243799 0.76 OPRL1 (0.50) RORCOPRL1SIGMAR1
SCHEMBL31593978 0.75 RORC (0.47) RORCOPRL1TAAR1SIGMAR1
SCHEMBL1807425 0.70 OPRL1 (0.47) RORCOPRL1
SCHEMBL31387399 0.67 OPRL1 (0.47) RORCOPRL1TAAR1SIGMAR1
Trifluoroacetic Acid SCHEMBL1808226 0.65 OPRL1 (0.45) RORCOPRL1TAAR1SIGMAR1
SCHEMBL18579655 0.65 OPRL1 (0.45) RORCOPRL1TAAR1SIGMAR1
SCHEMBL17037682 0.64 OTUD7B (0.56) SIGMAR1OTUD7B
SCHEMBL31387359 0.63 OPRL1 (0.41) RORCOPRL1TAAR1
SCHEMBL31387408 0.61 SIGMAR1 (0.39) RORCSIGMAR1

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
CN-119343353-A 2-Methyl-4 ',5' -dihydrospiro [ piperidine-4, 7' -thieno [2,3-c ] pyran ] derivatives as APOL1 inhibitors and methods of use thereof 弗特克斯药品有限公司 2025-01-21 CN disclosed