SCHEMBL9538016

SCHEMBL9538016

CN(C)/C=C1/CN(S(C)(=O)=O)c2ccc(Cl)cc2C1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ALDH1A1 P00352 4/20 0.35
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ ALDH2 P05091 2/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ ALDH3A1 P30838 1/20 0.34
▸ LMNA P02545 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ TSPO P30536 1/20 0.34
▸ GABRG2 P18507 5/20 0.34
▸ GABRB3 P28472 5/20 0.34
▸ GABRA5 P31644 5/20 0.34
▸ GABRA1 P14867 4/20 0.34
▸ GABRA3 P34903 4/20 0.34
▸ GABRA2 P47869 4/20 0.34
▸ GABRA6 Q16445 4/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL9538020 1.00 KDM4E (0.37) KDM4EMEN1KMT2AALDH1A1NPC1
SCHEMBL9536949 0.88 LMNA (0.36) KDM4EMEN1KMT2AALDH1A1ALDH2
SCHEMBL9536946 0.88 LMNA (0.36) KDM4EMEN1KMT2AALDH1A1ALDH2
SCHEMBL8230676 0.86 KCNA3 (0.48) MEN1KMT2AKCNA3
SCHEMBL9540647 0.83 LMNA (0.39) KDM4EMEN1KMT2AALDH1A1NPC1
SCHEMBL9540652 0.83 LMNA (0.39) KDM4EMEN1KMT2AALDH1A1NPC1
SCHEMBL9539218 0.76 ADORA3 (0.41) KDM4EMEN1KMT2AALDH1A1ALDH2
SCHEMBL9539213 0.76 ADORA3 (0.41) KDM4EMEN1KMT2AALDH1A1ALDH2
SCHEMBL9539134 0.75 CNR1 (0.37) KDM4EMEN1KMT2AALDH1A1RAB9A
SCHEMBL9539130 0.75 CNR1 (0.37) KDM4EMEN1KMT2AALDH1A1RAB9A

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
EP-0180352-B1 BENZENE-FUSED HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-26 — — EP disclosed
US-4767780-A SUBSTITUTED 1,4-DIHYDRO-(1)-BENZOPYRANO(4,3-C)PYRAZOLES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-08-30 — — US disclosed
US-4675324-A Substituted pyrazolo [4,3-c]pyridines and their use as uricosuric, diuretic and anti-hypertensive agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-06-23 — — US disclosed
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