SCHEMBL4479870

SCHEMBL4479870

OCc1ccc(-c2c3ccccc3nn2Cc2ccco2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.42
TSHR P16473 10/20 0.42
STAT3 P40763 1/20 0.41
FYN P06241 1/20 0.41
HSD17B10 Q99714 7/20 0.38
LMNA P02545 5/20 0.38
ALOX15 P16050 2/20 0.38
SMN1; SMN2 Q16637 6/20 0.38
NPSR1 Q6W5P4 3/20 0.38
KDM4E B2RXH2 5/20 0.38
MEN1 O00255 5/20 0.38
MAPT P10636 5/20 0.38
KMT2A Q03164 5/20 0.38
HPGD P15428 3/20 0.38
HTT P42858 3/20 0.38
TP53 P04637 2/20 0.38
POLB P06746 2/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
CASP1 P29466 1/20 0.38

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
SCHEMBL4485895 0.81 CYP1A2 (0.49) ALDH1A1TSHRHSD17B10LMNAALOX15
SCHEMBL4483240 0.79 KDM4E (0.50) ALDH1A1TSHRHSD17B10LMNASMN1; SMN2
SCHEMBL4479319 0.70 SMN1; SMN2 (0.52) ALDH1A1LMNASMN1; SMN2NPSR1KDM4E
SCHEMBL27688464 0.68 CYP1A2 (0.59) ALDH1A1LMNASMN1; SMN2NPSR1GAA
SCHEMBL4494497 0.66 ALDH1A1 (0.53) ALDH1A1LMNASMN1; SMN2NPSR1KDM4E
SCHEMBL4482187 0.66 NR1H2 (0.52) ALDH1A1LMNASMN1; SMN2NPSR1MEN1
SCHEMBL4470865 0.66 PTGER4 (0.64)
SCHEMBL27669279 0.65 CYP1A2 (0.49) ALDH1A1LMNASMN1; SMN2KDM4EMEN1
Benzyl Alcohol SCHEMBL14893121 0.65 TSHR (0.58) ALDH1A1TSHRHSD17B10LMNASMN1; SMN2
Benzyl Alcohol SCHEMBL27632993 0.65 TSHR (0.58) ALDH1A1TSHRHSD17B10LMNASMN1; 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-7514465-B2 Synthesis of N2-(substituted arylmethyl)-3-(substituted phenyl)indazoles as novel anti-angiogenic agents YUNG SHIN PHARM. IND. CO., LTD. (TW) 2009-04-07 US disclosed
EP-1659115-A1 Synthesis of substituted 2H-indazole derivatives as anti-angiogenic agents Yung Shin Pharm. Ind. Co., Ltd. (TW) 2006-05-24 EP disclosed