SCHEMBL27619817

SCHEMBL27619817

NC(=O)CCc1ccccc1O.c1cc2ccc1CO2

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 1/20 0.40
▸ AKR1B1 P15121 1/20 0.37
▸ NPC1 O15118 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ IAPP P10997 4/20 0.35
▸ HRH3 Q9Y5N1 3/20 0.35
▸ SIRT2 Q8IXJ6 1/20 0.34
▸ SIRT1 Q96EB6 1/20 0.34
▸ MTNR1A P48039 1/20 0.33
▸ TYR P14679 1/20 0.33
▸ HSPA5 P11021 1/20 0.33
▸ MPO P05164 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MGLL Q99685 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
SCHEMBL860002 0.82 TAAR1 (0.57) TAAR1AKR1B1NPC1PKMRAB9A
Salicyl Alcohol SCHEMBL8589411 0.77 HSPA5 (0.41) TAAR1AKR1B1RAB9AHRH3HSPA5
SCHEMBL9321175 0.71 MTNR1A (0.47) IAPPMTNR1AMPOALDH1A1
SCHEMBL30203505 0.69 IAPP (0.68) TAAR1AKR1B1IAPPMTNR1AMPO
SCHEMBL11751573 0.68 IAPP (0.59) TAAR1AKR1B1NPC1PKMRAB9A
SCHEMBL29373796 0.66 AKR1B1 (0.65) TAAR1AKR1B1NPC1PKMRAB9A
SCHEMBL35529 0.66 AKR1B1 (0.65) TAAR1AKR1B1NPC1PKMRAB9A
SCHEMBL7128255 0.66 AKR1B1 (0.65) TAAR1AKR1B1NPC1PKMRAB9A
SCHEMBL8967245 0.65 CYP4F2 (0.43) MTNR1AMPO
SCHEMBL269353 0.65 IAPP (0.72) TAAR1AKR1B1NPC1PKMRAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100341496-C Agent for preventing or treating kidney disease KISSEI PHARMACEUTICAL (JP) 2007-10-10 — — CN disclosed
CN-1652761-A Agent for preventing or treating kidney disease KISSEI PHARMACEUTICAL (JP) 2005-08-10 — — CN disclosed
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