SCHEMBL16401656

SCHEMBL16401656

[CH2]c1nn[nH]c1Cc1ccccc1C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
TSHR P16473 2/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PARP1 P09874 3/20 0.34
CSNK1A1 P48729 2/20 0.34
DYRK1B Q9Y463 2/20 0.34
PLK4 O00444 1/20 0.34
CHEK1 O14757 1/20 0.34
AURKA O14965 1/20 0.34
DAPK3 O43293 1/20 0.34
MAP4K4 O95819 1/20 0.34
CSF1R P07333 1/20 0.34
RET P07949 1/20 0.34
FGFR1 P11362 1/20 0.34
PDGFRA P16234 1/20 0.34
LTK P29376 1/20 0.34
KDR P35968 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
SCHEMBL7134588 0.74 TSHR (0.54) ALDH1A1KDM4ETSHRMAPTHPGD
SCHEMBL1004028 0.68 TSHR (0.58) ALDH1A1KDM4ETSHRMAPTHPGD
SCHEMBL5283405 0.67 KDM4E (0.50) ALDH1A1KDM4ETSHRMAPTHPGD
SCHEMBL4735612 0.66 ALDH1A1 (0.54) ALDH1A1KDM4ETSHRMAPTHPGD
Hydrochloric Acid SCHEMBL15690391 0.66 TSHR (0.56) ALDH1A1KDM4ETSHRMAPTHPGD
SCHEMBL5723905 0.66 HSPA5 (0.61) ALDH1A1KDM4ETSHRMAPTHPGD
SCHEMBL10604923 0.66 MAPT (0.46) ALDH1A1KDM4ETSHRMAPTHPGD
SCHEMBL1161694 0.66 CDC7 (0.50) ALDH1A1KDM4ETSHRMAPTHPGD
SCHEMBL6510427 0.66 MAPT (0.38) ALDH1A1KDM4ETSHRMAPTHPGD
SCHEMBL27940354 0.66 CYP1A2 (0.45) ALDH1A1KDM4ETSHRMAPTHPGD

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
WO-2015007613-A1 O-ALKYL TRIAZOLYL CARBAMATES AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE (FAAH) FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2015-01-22 WO disclosed