SCHEMBL7186148

SCHEMBL7186148

Cc1ccc(N(C)CCN)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2A6 P11509 1/20 0.43
▸ TAAR1 Q96RJ0 1/20 0.43
▸ NOS1 P29475 1/20 0.40
▸ NOS2 P35228 1/20 0.40
▸ CHRNA7 P36544 1/20 0.38
▸ CARM1 Q86X55 2/20 0.36
▸ ACHE P22303 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ PRMT6 Q96LA8 1/20 0.36
▸ PRMT8 Q9NR22 1/20 0.36
▸ MCOLN3 Q8TDD5 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ PRMT1 Q99873 1/20 0.36
▸ RAB9A P51151 1/20 0.35
▸ NEK1 Q96PY6 1/20 0.34

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
SCHEMBL17776058 0.87 ALDH1A1 (0.44) ALDH1A1TSHRCYP1A2CYP2A6TAAR1
SCHEMBL22537610 0.82 ALDH1A1 (0.48) ALDH1A1TSHRACHEMAPTMCOLN3
SCHEMBL12569403 0.81 ALDH1A1 (0.52) ALDH1A1TSHRCYP1A2CYP2A6TAAR1
SCHEMBL12789301 0.81 ALDH1A1 (0.52) ALDH1A1TSHRCHRNA7ACHEMAPT
SCHEMBL4378410 0.80 TAAR1 (0.42) ALDH1A1CYP2A6TAAR1NOS1NOS2
SCHEMBL29426388 0.80 APP (0.41) NOS1NOS2CARM1MAPTPRMT6
SCHEMBL22542480 0.80 TAAR1 (0.41) ALDH1A1TSHRTAAR1CARM1MAPT
SCHEMBL5188252 0.80 AOC3 (0.44) ALDH1A1TAAR1CARM1PRMT1
SCHEMBL12082337 0.79 ALDH1A1 (0.50) ALDH1A1TSHRCHRNA7ACHEMAPT
SCHEMBL16520720 0.79 ALDH1A1 (0.50) ALDH1A1TSHRCHRNA7ACHEMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008033460-A2 TREATING PAIN, DIABETES, AND LIPID METABOLISM DISORDERS SCHERING CORPORATION (US) 2008-03-20 — — WO disclosed
US-6641804-B1 Resin and a diluent, the resin (T) providing a resin film having at least one resin selected from the group consisting of vinyl resins, polyester resins, polyamide resins, silicone resins, cationic urethane resins, ampholytic urethane resins SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2003-11-04 — — US disclosed
EP-1068859-A1 HAIR TREATMENT AND METHOD OF TREATING HAIR SANYO CHEMICAL INDUSTRIES, Ltd. (JP) 2001-01-17 — — EP disclosed
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