SCHEMBL7987324

SCHEMBL7987324

COc1ccccc1C(C(=O)O)C(O)C1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ KMT2A Q03164 3/20 0.42
▸ METAP2 P50579 2/20 0.42
▸ METAP1 P53582 1/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ ATM Q13315 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ POLB P06746 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ TSHR P16473 1/20 0.40

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
SCHEMBL7990641 0.83 SGMS2 (0.52) ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL7987708 0.83 SGMS2 (0.52) ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL7975824 0.83 SGMS2 (0.52) ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL14862759 0.80 KMT2A (0.45) ALDH1A1HPGDSMN1; SMN2KMT2AL3MBTL1
SCHEMBL7975883 0.76 POLB (0.47) ALDH1A1HPGDSMN1; SMN2KMT2AL3MBTL1
SCHEMBL10897470 0.74 TACR1 (0.41) ALDH1A1HPGDSMN1; SMN2KMT2AL3MBTL1
SCHEMBL5511656 0.74 KMT2A (0.56) ALDH1A1HPGDSMN1; SMN2KMT2AL3MBTL1
SCHEMBL28104557 0.71 LMNA (0.42) ALDH1A1HPGDSMN1; SMN2LMNANPSR1
SCHEMBL11310166 0.71 LMNA (0.42) ALDH1A1HPGDSMN1; SMN2KMT2AMEN1
SCHEMBL10709995 0.71 SMN1; SMN2 (0.44) ALDH1A1HPGDSMN1; SMN2KMT2AL3MBTL1

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
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