SCHEMBL9632435

SCHEMBL9632435

COc1cc(O)n2ncnc2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.43
MAPK1 P28482 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
ENPP1 P22413 1/20 0.39
HPGD P15428 8/20 0.39
KDM4E B2RXH2 7/20 0.39
LMNA P02545 2/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
PDE2A O00408 1/20 0.38
PDE3B Q13370 1/20 0.38
HSD17B10 Q99714 2/20 0.37
NPSR1 Q6W5P4 2/20 0.36
PKM P14618 1/20 0.36
TSHR P16473 1/20 0.36
MAPT P10636 1/20 0.36
CYP1A2 P05177 1/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL19194891 0.83 ALDH1A1 (0.41) ALDH1A1MAPK1SMN1; SMN2ENPP1HPGD
SCHEMBL9677374 0.79 ALDH1A1 (0.43) ALDH1A1MAPK1SMN1; SMN2ENPP1HPGD
SCHEMBL272835 0.77 ALDH1A1 (0.67) ALDH1A1MAPK1SMN1; SMN2ENPP1HPGD
SCHEMBL13140144 0.76 HSD17B10 (0.41) ALDH1A1MAPK1HPGDKDM4EGAA
SCHEMBL7103183 0.76 ALDH1A1 (0.46) ALDH1A1MAPK1SMN1; SMN2ENPP1HPGD
SCHEMBL10725249 0.76 ALDH1A1 (0.40) ALDH1A1MAPK1SMN1; SMN2ENPP1HPGD
SCHEMBL5164814 0.75 ALDH1A1 (0.65) ALDH1A1MAPK1SMN1; SMN2ENPP1HPGD
SCHEMBL8421909 0.75 ALDH1A1 (0.65) ALDH1A1MAPK1SMN1; SMN2ENPP1HPGD
SCHEMBL19194460 0.72 EGLN2 (0.55) ALDH1A1MAPK1ENPP1HPGDKDM4E
SCHEMBL5983773 0.72 KDM1A (0.44) ALDH1A1MAPK1SMN1; SMN2ENPP1HPGD

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
EP-0257515-B1 METHOD FOR HARDENING LAYERS CONTAINING A PROTEIN BINDER Agfa-Gevaert AG (DE) 1992-05-13 EP disclosed
US-5028519-A Silver halide color photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 1991-07-02 US disclosed
EP-0257515-A2 Method for hardening layers containing a protein binder Agfa-Gevaert AG (DE) 1988-03-02 EP disclosed