SCHEMBL21379768

SCHEMBL21379768

N/C(=N\c1ccc(Cl)cc1)c1ccccc1N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR3E A5X5Y0 2/20 0.52
▸ HTR3B O95264 2/20 0.52
▸ HTR3A P46098 2/20 0.52
▸ HTR3D Q70Z44 2/20 0.52
▸ HTR3C Q8WXA8 2/20 0.52
▸ SLC22A2 O15244 1/20 0.52
▸ SLC22A1 O15245 1/20 0.52
▸ SLC22A3 O75751 1/20 0.52
▸ PLAU P00749 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ NOS3 P29474 4/20 0.45
▸ NOS1 P29475 4/20 0.45
▸ NOS2 P35228 4/20 0.45
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ RECQL P46063 1/20 0.40
▸ RAB9A P51151 2/20 0.39

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
SCHEMBL21379771 1.00 HTR3E (0.52) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL16468867 0.77 SMN1; SMN2 (0.57) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL8328537 0.76 MEN1 (0.73) HTR3EHTR3BHTR3AHTR3DHTR3C
Hydrochloric Acid SCHEMBL8328551 0.74 MEN1 (0.70) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL4215248 0.73 HTR3E (0.53) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL20017319 0.72 GAA (0.45) TDP1ALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL6344641 0.70 PLAU (0.50) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL28216082 0.70 CYP2D6 (0.54) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL1343391 0.70 GAA (0.52) CYP2C19KMT2AALDH1A1RAB9ASMN1; SMN2
SCHEMBL1343390 0.70 GAA (0.52) CYP2C19KMT2AALDH1A1RAB9ASMN1; SMN2

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
US-11209421-B2 Cytidine deaminase expression level in cancer as a new therapeutic target CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2021-12-28 — — US disclosed
US-20190293629-A1 CYTIDINE DEAMINASE EXPRESSION LEVEL IN CANCER AS A NEW THERAPEUTIC TARGET CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2019-09-26 — — US disclosed
Send feedback