SCHEMBL6979231

SCHEMBL6979231

O=c1c(Cc2ccccc2)cn2c3ccc(Cl)cc3c3cc(Cl)cc1c32

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.53
SLC5A2 P31639 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP3A4 P08684 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
HIF1A Q16665 1/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 1/20 0.40
DNMT1 P26358 3/20 0.39
PTGER1 P34995 1/20 0.39
ACLY P53396 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
TOP2A P11388 1/20 0.37
TOP2B Q02880 1/20 0.37
CTRC Q99895 1/20 0.37
NR1H2 P55055 1/20 0.36
LMNA P02545 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
SCHEMBL7666630 0.82 EGFR (0.47) EGFRSLC5A2MEN1KMT2AHSD17B10
SCHEMBL8159124 0.81 GABRA5 (0.41) EGFRKMT2AALDH1A1
SCHEMBL7670695 0.78 GABRA5 (0.43) EGFRKMT2AALDH1A1
SCHEMBL6975094 0.78 GABRA5 (0.38) EGFRKMT2A
SCHEMBL6982751 0.78 GABRA5 (0.38) EGFRMEN1KMT2ACYP3A4ALDH1A1
SCHEMBL6981471 0.78 GABRA5 (0.43) EGFRKMT2AALDH1A1MAPTLMNA
SCHEMBL7668624 0.76 P2RX4 (0.47) EGFRHPGDALDH1A1MAPTCTRC
SCHEMBL6971385 0.75 CYP19A1 (0.43) ALDH1A1MAPT
SCHEMBL6981401 0.74 ALDH1A1 (0.44) EGFRHPGDALDH1A1LMNA
SCHEMBL7672597 0.73 PTGER1 (0.38) EGFRSLC5A2MEN1KMT2AHSD17B10

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-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