SCHEMBL7975980

SCHEMBL7975980

O=C(O)C(CCc1ccccc1OCc1ccccc1)C(O)C1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SGMS2 Q8NHU3 1/20 0.48
▸ PTGER1 P34995 4/20 0.47
▸ PTGER4 P35408 4/20 0.47
▸ PTGER3 P43115 4/20 0.47
▸ PTGER2 P43116 4/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ HTR1A P08908 1/20 0.46
▸ DRD2 P14416 1/20 0.46
▸ DPP7 Q9UHL4 1/20 0.42
▸ SLC1A5 Q15758 1/20 0.41
▸ ABCB1 P08183 4/20 0.41
▸ FOLH1 Q04609 1/20 0.40
▸ SCN9A Q15858 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ MGLL Q99685 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
SCHEMBL8817317 1.00 SGMS2 (0.48) SGMS2PTGER1PTGER4PTGER3PTGER2
SCHEMBL7990565 0.89 SGMS2 (0.50) SGMS2PTGER1PTGER4PTGER3PTGER2
SCHEMBL7989643 0.89 SGMS2 (0.50) SGMS2PTGER1PTGER4PTGER3PTGER2
SCHEMBL7990312 0.80 ITGB2 (0.49) —
SCHEMBL7975824 0.77 SGMS2 (0.52) SGMS2PTGER1PTGER4PTGER3PTGER2
SCHEMBL7990641 0.77 SGMS2 (0.52) SGMS2PTGER1PTGER4PTGER3PTGER2
SCHEMBL7987708 0.77 SGMS2 (0.52) SGMS2PTGER1PTGER4PTGER3PTGER2
SCHEMBL7993776 0.77 ERAP2 (0.52) —
SCHEMBL7990821 0.73 TDP1 (0.47) SGMS2MEN1ALDH1A1KMT2ATSHR
SCHEMBL7975922 0.73 SGMS2 (0.46) SGMS2PTGER1PTGER4PTGER3PTGER2

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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