SCHEMBL6983342

SCHEMBL6983342

COc1ccc(OCCCOc2cc3c(=O)c(Cc4cccnc4)cn4c5cc(Cl)ccc5c(c2)c34)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 3/20 0.44
PLA2G7 Q13093 3/20 0.41
MCL1 Q07820 4/20 0.38
GABRA5 P31644 4/20 0.37
GABRA1 P14867 3/20 0.37
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
LTA4H P09960 1/20 0.35
PIK3CD O00329 1/20 0.35
MAPK8 P45983 1/20 0.35
GRM2 Q14416 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
SCHEMBL6977996 0.89 MCL1 (0.39) MAT2APLA2G7MCL1GABRA5GABRA1
SCHEMBL6979997 0.89 MCL1 (0.42) MAT2APLA2G7MCL1GABRA5GABRA1
Hydrochloric Acid SCHEMBL6973682 0.88 MCL1 (0.39) MAT2APLA2G7MCL1GABRA5GABRA1
SCHEMBL6979995 0.86 MCL1 (0.44) MAT2APLA2G7MCL1
SCHEMBL6981471 0.84 GABRA5 (0.43) MAT2APLA2G7GABRA5GABRA1ALDH1A1
SCHEMBL6980050 0.81 GABRA1 (0.39) MAT2AGABRA5GABRA1ALDH1A1MAPT
SCHEMBL6979014 0.81 GABRA1 (0.41) GABRA5GABRA1ALDH1A1MAPT
SCHEMBL6981678 0.81 GABRA1 (0.46) GABRA5GABRA1ALDH1A1MAPT
SCHEMBL6981815 0.80 GABRA1 (0.46) GABRA5GABRA1ALDH1A1MAPT
SCHEMBL7084095 0.79 GABRA1 (0.36) PLA2G7MCL1GABRA5GABRA1GRM2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0985671-B1 PYRIDOCARBAZOLE DERIVATIVES HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARM CO LTD (JP) 2003-04-02 EP disclosed
US-6197768-B1 THERAPY, PREVENTION ISCHEMIC HEART DISEASE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2001-03-06 US disclosed
EP-0992240-A1 THERAPEUTIC AGENT FOR ERECTION FAILURE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-04-12 EP disclosed
US-6018046-A SELECTIVE ACTION IN INHIBITING CYCLIC GMP-PHOSPHODIESTERASE (CGMP-PDE); PHARMACEUTICALS FOR TREATING DISEASES AGAINST WHICH THE INHIBITORY ACTION IS EFFECTIVE, SUCH AS PULMONARY HYPERTENSION MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-01-25 US disclosed