SCHEMBL11187463

SCHEMBL11187463

CC(C)N1CC2NCCc3c2n(c2ccccc32)C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ PER2 O15055 6/20 0.35
▸ HTR2A P28223 1/20 0.34
▸ HTR2C P28335 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ NR1I2 O75469 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ TAAR1 Q96RJ0 1/20 0.32

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
SCHEMBL11187623 0.84 HSD17B10 (0.41) HSD17B10ALDH1A1MEN1HPGDKMT2A
SCHEMBL11206732 0.83 MEN1 (0.38) HSD17B10ALDH1A1MEN1HPGDKMT2A
SCHEMBL11185140 0.81 HSD17B10 (0.39) HSD17B10ALDH1A1MEN1HPGDKMT2A
SCHEMBL11185552 0.77 HPGD (0.38) HSD17B10ALDH1A1MEN1HPGDKMT2A
SCHEMBL11190506 0.77 ALDH1A1 (0.37) HSD17B10ALDH1A1MEN1HPGDKMT2A
SCHEMBL11193303 0.76 HSD17B10 (0.45) HSD17B10ALDH1A1MEN1HPGDKMT2A
SCHEMBL11190156 0.75 HSD17B10 (0.35) HSD17B10ALDH1A1MEN1HPGDKMT2A
Hydrochloric Acid SCHEMBL11191037 0.75 HSD17B10 (0.47) HSD17B10ALDH1A1MEN1HPGDKMT2A
SCHEMBL10836067 0.75 HSD17B10 (0.50) HSD17B10ALDH1A1MEN1HPGDKMT2A
SCHEMBL11215182 0.74 MEN1 (0.34) HSD17B10ALDH1A1MEN1HPGDKMT2A

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-4367230-A ANTIANOXIC AGENTS TANABE SEIYAKU CO., LTD. (JP) 1983-01-04 — — US disclosed
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