SCHEMBL31384417

SCHEMBL31384417

CNc1ccc(Cl)cc1C(=O)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.67
ALDH1A1 P00352 3/20 0.65
LMNA P02545 2/20 0.65
GAA P10253 3/20 0.63
KDM4E B2RXH2 1/20 0.63
GLA P06280 1/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
TP53 P04637 3/20 0.62
HTT P42858 1/20 0.61
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
SERPINE1 P05121 1/20 0.58
TSHR P16473 1/20 0.58
THRB P10828 1/20 0.56

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
SCHEMBL333291 1.00 MAPT (0.67) MAPTALDH1A1LMNAGAAKDM4E
Ammonia Solution, Strong SCHEMBL28210514 0.98 MAPT (0.65) MAPTALDH1A1LMNAGAAKDM4E
Ethane SCHEMBL11534058 0.98 MAPT (0.65) MAPTALDH1A1LMNAGAAKDM4E
Glycine SCHEMBL11600509 0.91 SMN1; SMN2 (0.58) MAPTALDH1A1LMNAGAAKDM4E
SCHEMBL8959210 0.90 ALDH1A1 (0.67) MAPTALDH1A1LMNAGAAKDM4E
SCHEMBL11827090 0.86 MAPT (0.72) MAPTALDH1A1LMNAGAAKDM4E
SCHEMBL31000396 0.86 MAPT (0.72) MAPTALDH1A1LMNAGAAKDM4E
SCHEMBL15906641 0.85 CCR9 (0.64) MAPTALDH1A1LMNAGAAKDM4E
SCHEMBL10800720 0.84 MAPT (0.64) MAPTALDH1A1LMNAGAAKDM4E
SCHEMBL11636235 0.84 SMN1; SMN2 (0.64) MAPTALDH1A1LMNAGAASMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117229206-B Preparation method for synthesizing polysubstituted 2-quinolinone compound by base catalysis 延安大学 2025-01-03 CN disclosed