SCHEMBL7975883

SCHEMBL7975883

COc1ccccc1CC(C(=O)O)C(O)C1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HPGD P15428 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ LMNA P02545 1/20 0.44
▸ SIGMAR1 Q99720 1/20 0.43
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41

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
SCHEMBL7989643 0.84 SGMS2 (0.50) GAAALDH1A1MEN1KMT2A
SCHEMBL7990565 0.84 SGMS2 (0.50) GAAALDH1A1MEN1KMT2A
SCHEMBL7987324 0.76 ALDH1A1 (0.47) POLBSMN1; SMN2HPGDALDH1A1MEN1
SCHEMBL7990821 0.75 TDP1 (0.47) POLBALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL14874433 0.75 POLB (0.47) POLBSMN1; SMN2HPGDGAAALDH1A1
SCHEMBL8655892 0.74 LMNA (0.48) POLBSMN1; SMN2HPGDGAAALDH1A1
SCHEMBL8953561 0.73 KMT2A (0.50) POLBSMN1; SMN2HPGDGAAALDH1A1
SCHEMBL16815732 0.73 KMT2A (0.50) POLBSMN1; SMN2HPGDGAAALDH1A1
SCHEMBL463315 0.73 KMT2A (0.50) POLBSMN1; SMN2HPGDGAAALDH1A1
SCHEMBL1419560 0.73 KMT2A (0.53) POLBHPGDGAAALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6207686-B1 FOR THERAPY OF HYPERTENSION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-03-27 — — US disclosed
EP-0792265-A1 ENDOTHELIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-09-03 — — EP disclosed
WO-1996015109-A1 ENDOTHELIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-05-23 — — WO disclosed
Send feedback