SCHEMBL25165451

SCHEMBL25165451

c1ncc(-c2ncc(-c3cc4cc5cc6sc(-c7cnc(-c8cncnc8)s7)cc6cc5cc4s3)s2)cn1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 2/20 0.33
▸ HSD17B2 P37059 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGDS O60760 1/20 0.33

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
SCHEMBL25165305 0.79 ESR1 (0.32) HSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL26745571 0.77 APP (0.33) HSD17B1HSD17B2CYP3A4CYP2C9HPGDS
SCHEMBL25165769 0.77 HSD17B1 (0.40) HSD17B1HSD17B2CYP3A4CYP2C9HPGDS
SCHEMBL25165229 0.76 CYP19A1 (0.35) HSD17B1HSD17B2CYP3A4CYP2C9HPGDS
SCHEMBL26500409 0.76 — —
SCHEMBL26500354 0.75 — —
SCHEMBL25165436 0.75 ADORA2A (0.30) —
SCHEMBL26500407 0.74 DYRK1A (0.33) —
SCHEMBL25165433 0.74 IKBKB (0.33) —
SCHEMBL25165281 0.74 DYRK1A (0.36) HSD17B1HSD17B2CYP3A4CYP2C9

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
US-20230121151-A1 PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, OPTICAL SENSOR, AND COMPOUND FUJIFILM CORPORATION (JP) 2023-04-20 — — US disclosed
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