SCHEMBL9540647

SCHEMBL9540647

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ ALDH2 P05091 2/20 0.39
▸ ALDH3A1 P30838 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ OPRK1 P41145 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ TSPO P30536 1/20 0.39
▸ NR1I2 O75469 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ ADRA1A P35348 1/20 0.39
▸ PTGS2 P35354 1/20 0.39
▸ CHRNA4 P43681 1/20 0.39
▸ SLC6A3 Q01959 1/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ GABRG2 P18507 7/20 0.38

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
SCHEMBL9540652 1.00 LMNA (0.39) LMNAALDH1A1ALDH2ALDH3A1SMN1; SMN2
SCHEMBL9538020 0.83 KDM4E (0.37) LMNAALDH1A1ALDH2ALDH3A1SMN1; SMN2
SCHEMBL9538016 0.83 KDM4E (0.37) LMNAALDH1A1ALDH2ALDH3A1SMN1; SMN2
SCHEMBL9536949 0.81 LMNA (0.36) LMNAALDH1A1ALDH2ALDH3A1SMN1; SMN2
SCHEMBL9536946 0.81 LMNA (0.36) LMNAALDH1A1ALDH2ALDH3A1SMN1; SMN2
SCHEMBL8230676 0.80 KCNA3 (0.48) MEN1KMT2A
SCHEMBL9539218 0.79 ADORA3 (0.41) ALDH1A1ALDH2ALDH3A1SMN1; SMN2KDM4E
SCHEMBL9539213 0.79 ADORA3 (0.41) ALDH1A1ALDH2ALDH3A1SMN1; SMN2KDM4E
SCHEMBL9539134 0.78 CNR1 (0.37) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL9539130 0.78 CNR1 (0.37) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A

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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