SCHEMBL9035650

SCHEMBL9035650

NNC(=O)Nc1ccc(Cl)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.58
NPC1 O15118 4/20 0.54
KDM4E B2RXH2 3/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPT P10636 7/20 0.54
KMT2A Q03164 3/20 0.54
HTT P42858 2/20 0.54
POLB P06746 1/20 0.54
MEN1 O00255 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.52
TRPV1 Q8NER1 1/20 0.51
PYGL P06737 1/20 0.51
ATM Q13315 1/20 0.50
PDK1 Q15118 1/20 0.50
PDK2 Q15119 1/20 0.50
PDK3 Q15120 1/20 0.50
PDK4 Q16654 1/20 0.50
USP2 O75604 1/20 0.50
HPGD P15428 1/20 0.50

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
Hydrochloric Acid SCHEMBL9004742 0.98 RAB9A (0.56) RAB9ANPC1KDM4EALDH1A1MAPT
SCHEMBL5471126 0.88 RAB9A (0.65) RAB9ANPC1KDM4EALDH1A1MAPT
SCHEMBL6765299 0.83 RAB9A (0.59) RAB9ANPC1KDM4EALDH1A1MAPT
SCHEMBL5867147 0.81 RAB9A (0.58) RAB9ANPC1KDM4EALDH1A1MAPT
SCHEMBL4799616 0.81 NPC1 (0.61) RAB9ANPC1KDM4EALDH1A1HTT
SCHEMBL30274478 0.81 NPC1 (0.61) RAB9ANPC1KDM4EALDH1A1HTT
SCHEMBL12919798 0.80 RAB9A (0.56) RAB9ANPC1KDM4EALDH1A1MAPT
SCHEMBL21858368 0.80 ALDH1A1 (0.70) RAB9ANPC1KDM4EALDH1A1MAPT
SCHEMBL31206286 0.80 ALDH1A1 (0.70) RAB9ANPC1KDM4EALDH1A1MAPT
SCHEMBL31206327 0.80 MAPT (0.66) RAB9ANPC1KDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108558756-B 2-aryl-2, 3-dihydro-4 (1H) -quinolinone semicarbazone compound and application thereof 沈阳药科大学 2021-08-03 CN disclosed
CN-108558756-A 2-aryl-2, 3-dihydro-4 (1H) -quinolinone semicarbazone compound and application thereof 沈阳药科大学 2018-09-21 CN disclosed
EP-0566445-B1 Derivatives of indane 1,3-dione and indane-1,2,3-trione, processes for their preparation and their application in therapy INNOTHERA LAB SA (FR) 1996-02-07 EP disclosed
EP-0566445-A1 Derivatives of indane 1,3-dione and indane-1,2,3-trione, processes for their preparation and their application in therapy INNOTHERA (FR) 1993-10-20 EP disclosed
WO-1993020045-A1 INDAN-1,3-DIONE AND INDAN-1,2,3-TRIONE DERIVATIVES, PROCESSES FOR THE PREPARATION OF SAME AND THEIR APPLICATION AS THERAPEUTIC AGENTS INNOTHERA (FR) 1993-10-14 WO disclosed