SCHEMBL29457652

SCHEMBL29457652

NC1CCC1c1ccc(Cl)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.53
HTR2C P28335 1/20 0.53
HTR2B P41595 1/20 0.53
DPP4 P27487 11/20 0.53
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
AGTR1 P30556 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL16211980 1.00 HTR2A (0.53) HTR2AHTR2CHTR2BDPP4GAA
SCHEMBL22437509 1.00 HTR2A (0.53) HTR2AHTR2CHTR2BDPP4GAA
SCHEMBL16372470 1.00 HTR2A (0.53) HTR2AHTR2CHTR2BDPP4GAA
SCHEMBL29023699 1.00 HTR2A (0.53) HTR2AHTR2CHTR2BDPP4GAA
SCHEMBL29023696 1.00 HTR2A (0.53) HTR2AHTR2CHTR2BDPP4GAA
Hydrochloric Acid SCHEMBL16372240 0.98 HTR2A (0.56) HTR2AHTR2CHTR2BDPP4GAA
SCHEMBL1643851 0.89 DPP4 (0.50) HTR2AHTR2CHTR2BDPP4GAA
SCHEMBL1643847 0.89 DPP4 (0.50) HTR2AHTR2CHTR2BDPP4GAA
SCHEMBL1644655 0.89 DPP4 (0.50) HTR2AHTR2CHTR2BDPP4GAA
SCHEMBL3748591 0.89 DPP4 (0.50) HTR2AHTR2CHTR2BDPP4GAA

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
CN-114163382-B Cyclobutanamide compound or salts and composition acceptable by pesticides and application thereof 海利尔药业集团股份有限公司 2024-02-27 CN disclosed
CN-111417618-B Process for preparing enantiomerically and diastereomerically enriched cyclobutane amines and amides 先正达参股股份有限公司 2023-06-30 CN disclosed
CN-114163382-A Cyclobutanamide compound or salt thereof acceptable as pesticide, composition and application thereof 海利尔药业集团股份有限公司 2022-03-11 CN disclosed