SCHEMBL29915675

SCHEMBL29915675

CC1c2ccccc2NC(=S)N1C

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 11/20 0.43
GPR3 P46089 1/20 0.43
EGFR P00533 5/20 0.37
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SRC P12931 1/20 0.34
PIM1 P11309 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
SCHEMBL2523848 1.00 HTR5A (0.43) HTR5AGPR3EGFRALDH1A1MEN1
Hydrochloric Acid SCHEMBL5711670 0.98 HTR5A (0.42) HTR5AGPR3EGFRALDH1A1MEN1
SCHEMBL2520126 0.81 HTR5A (0.43) HTR5AGPR3ALDH1A1KMT2A
SCHEMBL29915930 0.81 HTR5A (0.43) HTR5AGPR3ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL5711485 0.79 HTR5A (0.42) HTR5AGPR3ALDH1A1KMT2A
SCHEMBL10061676 0.79 HTR5A (0.42) HTR5AGPR3
SCHEMBL5873718 0.69 EGFR (0.47) HTR5AEGFRALDH1A1MEN1KMT2A
SCHEMBL20385185 0.68 HTR5A (0.48) HTR5AMEN1KMT2A
SCHEMBL31474673 0.68 HTR5A (0.48) HTR5AMEN1KMT2A
SCHEMBL13366003 0.68 HTR5A (0.48) HTR5AMEN1KMT2A

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
CN-114746069-A Three-step multi-tone hair dyeing method 汉高股份有限及两合公司 2022-07-12 CN disclosed