SCHEMBL6972180

SCHEMBL6972180

[O]Cc1cncc(CO)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.41
CYP11B2 P19099 6/20 0.38
CYP11B1 P15538 4/20 0.38
KDM4E B2RXH2 1/20 0.35
DYRK1A Q13627 1/20 0.34
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
ACHE P22303 1/20 0.33
AR P10275 1/20 0.33
MKNK1 Q9BUB5 1/20 0.31
MKNK2 Q9HBH9 1/20 0.31
PRKCI P41743 1/20 0.31
KDM5B Q9UGL1 1/20 0.31
RECQL P46063 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30

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
SCHEMBL2728918 0.87 CYP2A6 (0.47) CYP2A6CYP11B2CYP11B1KDM4EDYRK1A
Acetic Acid SCHEMBL6983638 0.79 CYP2A6 (0.43) CYP2A6CYP11B2CYP11B1KDM4EDYRK1A
SCHEMBL844561 0.76 CYP2A6 (0.44) CYP2A6CYP11B2CYP11B1DYRK1AACHE
SCHEMBL7669052 0.76
SCHEMBL21549405 0.76
SCHEMBL6982748 0.76 SMYD3 (0.37) CYP11B2PRMT5WDR77
SCHEMBL29318109 0.76 CYP2A6 (0.41) CYP2A6CYP11B2CYP11B1KDM4EDYRK1A
SCHEMBL5514245 0.76 CYP2A6 (0.41) CYP2A6CYP11B2CYP11B1KDM4EDYRK1A
SCHEMBL25236225 0.76 CYP2A6 (0.38) CYP2A6CYP11B2CYP11B1KDM4EDYRK1A
SCHEMBL2902974 0.73

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 7 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-6476021-B1 Compounds having cGMP-PDE inhibitory effect MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2002-11-05 US disclosed
US-6197768-B1 THERAPY, PREVENTION ISCHEMIC HEART DISEASE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2001-03-06 US disclosed
EP-1048666-A1 NOVEL COMPOUNDS HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 EP disclosed
EP-0992240-A1 THERAPEUTIC AGENT FOR ERECTION FAILURE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-04-12 EP disclosed
EP-0985671-A1 PYRIDOCARBAZOLE DERIVATIVES HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-03-15 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