SCHEMBL7976306

SCHEMBL7976306

O=c1[nH]nc(-c2cccc3ccccc23)c2ccccc12.O=c1[nH]ncc2cc(Cl)ccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
HSD17B10 Q99714 2/20 0.49
PDE4B Q07343 2/20 0.49
PARP1 P09874 1/20 0.49
PRKCI P41743 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
LMNA P02545 5/20 0.43
NPSR1 Q6W5P4 2/20 0.43
HTT P42858 2/20 0.43
ATM Q13315 1/20 0.42
KMT2A Q03164 2/20 0.41
ROCK1 Q13464 3/20 0.41
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
TYMP P19971 1/20 0.39
BRD4 O60885 1/20 0.39
MEN1 O00255 1/20 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
SCHEMBL2230907 0.81 ATM (0.61) ALDH1A1HSD17B10PDE4BPARP1PRKCI
SCHEMBL601322 0.78 NOS1 (0.56) ALDH1A1HSD17B10PDE4BPARP1PRKCI
SCHEMBL17829693 0.72 HTR2A (0.46) ALDH1A1HSD17B10NPSR1KMT2AROCK1
SCHEMBL5399593 0.71 HSD17B10 (0.47) ALDH1A1HSD17B10PDE4BPARP1PRKCI
SCHEMBL1788378 0.70 NPSR1 (0.67) ALDH1A1HSD17B10PDE4BLMNANPSR1
SCHEMBL7892211 0.70 NPSR1 (0.61) ALDH1A1HSD17B10PDE4BLMNANPSR1
Phthalazinone SCHEMBL51553 0.69 PARP1 (1.00) ALDH1A1HSD17B10PDE4BPARP1PRKCI
SCHEMBL5485566 0.69 ALDH1A1 (0.47) ALDH1A1HSD17B10PDE4BPARP1PRKCI
SCHEMBL31014288 0.68 ATM (0.73) ALDH1A1HSD17B10PDE4BLMNANPSR1
SCHEMBL706420 0.68 ATM (0.73) ALDH1A1HSD17B10PDE4BLMNANPSR1

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
US-6309814-B1 MIXTURE OF ORGANIC SILVER SALT, SILVER HALIDE EMULSIONS AND BINDER FUJI PHOTO FILM CO., LTD. (JP) 2001-10-30 US disclosed