SCHEMBL9124579

SCHEMBL9124579

O=C(OCc1ccccc1)c1ccccc1C(c1ccc(OCc2ccccc2)cc1)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.52
▸ TDP1 Q9NUW8 3/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ NR4A1 P22736 1/20 0.49
▸ NR4A2 P43354 1/20 0.49
▸ NR4A3 Q92570 1/20 0.49
▸ PRKCA P17252 2/20 0.48
▸ PRKCD Q05655 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ ALOX5 P09917 1/20 0.47
▸ LTA4H P09960 1/20 0.47
▸ LAP3 P28838 1/20 0.47
▸ MAOB P27338 1/20 0.47
▸ PARP10 Q53GL7 1/20 0.47
▸ LMNA P02545 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
SCHEMBL15397422 0.77 ALDH1A1 (0.65) ALDH1A1TDP1L3MBTL1CYP3A4TSHR
SCHEMBL5836722 0.77 HTT (0.57) ALDH1A1TDP1L3MBTL1CYP3A4TSHR
SCHEMBL11467759 0.76 LTA4H (0.56) L3MBTL1NR4A1NR4A2NR4A3PRKCA
SCHEMBL11252632 0.76 LTA4H (0.56) L3MBTL1NR4A1NR4A2NR4A3PRKCA
SCHEMBL824976 0.76 LMNA (0.64) L3MBTL1NR4A1NR4A2NR4A3GAA
SCHEMBL2032112 0.76 LMNA (0.64) L3MBTL1NR4A1NR4A2NR4A3GAA
SCHEMBL7761599 0.75 NR4A1 (0.62) NR4A1NR4A2NR4A3ALOX5MAOB
SCHEMBL50807 0.75 KMT2A (0.73) ALDH1A1TDP1L3MBTL1NR4A1NR4A2
SCHEMBL9121818 0.75 LMNA (0.51) L3MBTL1NR4A1NR4A2NR4A3PRKCA
SCHEMBL21755634 0.75 ALDH1A1 (0.58) ALDH1A1TDP1L3MBTL1CYP3A4TSHR

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
US-5413997-A For treatment of osteoporosis KYOWA HAKKO KOGYO CO., LTD. (JP) 1995-05-09 — — US disclosed
EP-0395093-B1 TRIPHENYLMETHANE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1993-09-01 — — EP disclosed
US-5112867-A Osteoporosis Treatment KYOWA HAKKO GOGYO CO., LTD. (JP) 1992-05-12 — — US disclosed
EP-0395093-A1 Triphenylmethane derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1990-10-31 — — EP disclosed
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