SCHEMBL7669097

SCHEMBL7669097

COc1ccc2[nH]c3cc(Br)ccc3c(=O)c2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.68
ALDH1A1 P00352 7/20 0.57
KDM4E B2RXH2 7/20 0.57
HSD17B10 Q99714 3/20 0.57
MAPT P10636 3/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
TSHR P16473 1/20 0.57
GFER P55789 1/20 0.57
CTSV O60911 1/20 0.57
CTSL P07711 1/20 0.57
STING1 Q86WV6 1/20 0.57
CDK4 P11802 1/20 0.55
CCND1 P24385 1/20 0.55
HPGD P15428 5/20 0.50
FLT3 P36888 1/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CCNB2 O95067 1/20 0.46

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
SCHEMBL6972469 0.88 KDM4E (0.70) ABCG2ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL14668902 0.86 ABCG2 (0.78) ABCG2ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL12285521 0.86 ABCG2 (0.83) ABCG2ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL10171024 0.84 HSD17B10 (0.53) ABCG2ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL10165568 0.82 CDK4 (0.61) ABCG2ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL6976263 0.82 ALDH1A1 (0.78) ABCG2ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL31188764 0.82 ALDH1A1 (0.78) ABCG2ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL9709251 0.82 ABCG2 (0.68) ABCG2ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL14668878 0.82 ABCG2 (0.94) ABCG2ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL22633747 0.81 KDM4E (0.65) ABCG2ALDH1A1KDM4EHSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6476021-B1 Compounds having cGMP-PDE inhibitory effect MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2002-11-05 US disclosed
EP-1048666-A1 NOVEL COMPOUNDS HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 EP disclosed