SCHEMBL29825931

SCHEMBL29825931

Cc1ccc(N(C)c2cccc(OC3CCNCC3)c2)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HRH1 P35367 3/20 0.43
▸ HTR2C P28335 5/20 0.40
▸ HTR2B P41595 3/20 0.40
▸ SLC6A4 P31645 4/20 0.39
▸ SLC6A2 P23975 3/20 0.39
▸ SLC6A3 Q01959 2/20 0.39
▸ HTR6 P50406 1/20 0.39
▸ NMT1 P30419 2/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ IKBKB O14920 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
SCHEMBL30740685 0.77 GBA1 (0.43) HTR2CSLC6A4SLC6A2SLC6A3HTR6
SCHEMBL29825954 0.77 MEN1 (0.47) —
SCHEMBL29994671 0.76 HRH1 (0.62) HRH1HTR2CHTR2BSLC6A4SLC6A2
SCHEMBL8358502 0.76 HRH1 (0.62) HRH1HTR2CHTR2BSLC6A4SLC6A2
Hydrochloric Acid SCHEMBL70482 0.74 HRH1 (0.61) HRH1HTR2CHTR2BSLC6A4SLC6A2
SCHEMBL30740706 0.71 GSK3B (0.32) HTR2CHTR1A
SCHEMBL5369456 0.70 HTR2C (0.51) HRH1HTR2CHTR2BSLC6A4HTR6
SCHEMBL29994691 0.70 HRH1 (0.62) HRH1HTR2CHTR2BSLC6A4SLC6A2
SCHEMBL2300978 0.70 HRH1 (0.62) HRH1HTR2CHTR2BSLC6A4SLC6A2
SCHEMBL30740728 0.69 CYP1A2 (0.35) HTR1A

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
EP-4284795-A1 GPCR RECEPTOR AGONISTS, PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME, AND METHODS FOR THEIR USE Carmot Therapeutics, Inc. (US) 2023-12-06 — — EP disclosed
CN-117043154-A GPCR receptor agonists, pharmaceutical compositions comprising same, and methods of use thereof 卡莫特医疗有限公司 2023-11-10 — — CN disclosed
WO-2022165076-A1 GPCR RECEPTOR AGONISTS, PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME, AND METHODS FOR THEIR USE CARMOT THERAPEUTICS, INC. (US) 2022-08-04 — — WO disclosed
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