SCHEMBL19347397

SCHEMBL19347397

CCNc1cccc(C(=O)O)n1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.67
▸ LMNA P02545 1/20 0.67
▸ ALOX15 P16050 1/20 0.55
▸ TSHR P16473 1/20 0.55
▸ ACMSD Q8TDX5 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ KCNH2 Q12809 1/20 0.50
▸ CACNA1C Q13936 1/20 0.50
▸ SCN5A Q14524 1/20 0.50
▸ HCAR3 P49019 1/20 0.47
▸ CNR1 P21554 1/20 0.44
▸ GRM5 P41594 1/20 0.44
▸ MRGPRX4 Q96LA9 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ MAPK8 P45983 1/20 0.41
▸ ECE1 P42892 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
SCHEMBL18167973 0.86 KDM4E (0.58) KDM4ELMNAALOX15TSHRACMSD
SCHEMBL15650342 0.84 KCNH2 (0.49) KDM4ELMNAKCNH2CACNA1CSCN5A
SCHEMBL18167999 0.83 KDM4E (0.55) KDM4ELMNAALOX15TSHRACMSD
SCHEMBL1040553 0.83 GRM5 (0.49) KDM4ELMNAKCNH2CACNA1CSCN5A
SCHEMBL16834707 0.81 KDM4E (0.57) KDM4ELMNAALOX15TSHRACMSD
SCHEMBL18575634 0.81 KDM4E (0.57) KDM4ELMNAALOX15TSHRACMSD
SCHEMBL2639071 0.81 KDM4E (0.56) KDM4ELMNAALOX15TSHRACMSD
SCHEMBL2251120 0.80 KDM4E (1.00) KDM4ELMNAALOX15TSHRACMSD
SCHEMBL29484609 0.80 KDM4E (1.00) KDM4ELMNAALOX15TSHRACMSD
SCHEMBL3117402 0.79 KDM4E (0.68) KDM4ELMNAALOX15TSHRACMSD

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
WO-2021216812-A1 GALACTOKINASE INHIBITORS UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2021-10-28 — — WO disclosed
WO-2017153527-A1 NOVEL INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE GAMMA ASTRAZENECA AB (SE) 2017-09-14 — — WO disclosed
CN-1332942-C Sulfonylamino-acetic acid derivatives and their use as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD (CH) 2007-08-22 — — CN disclosed
CN-1703397-A Sulfonylamino-acetic acid derivatives and their use as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD (CH) 2005-11-30 — — CN disclosed
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