SCHEMBL9036508

SCHEMBL9036508

COc1ccccc1NC(=O)NN

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.71
POLB P06746 1/20 0.64
MAPT P10636 6/20 0.62
SMN1; SMN2 Q16637 4/20 0.62
RAB9A P51151 3/20 0.62
NPC1 O15118 2/20 0.62
L3MBTL1 Q9Y468 1/20 0.61
GAA P10253 2/20 0.59
HTT P42858 2/20 0.59
LMNA P02545 1/20 0.59
KDM4E B2RXH2 1/20 0.59
HPGD P15428 1/20 0.59
HSD17B10 Q99714 1/20 0.59
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA9 Q16790 1/20 0.58
LPAR1 Q92633 1/20 0.57

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 SCHEMBL9004628 0.98 ALDH1A1 (0.69) ALDH1A1POLBMAPTSMN1; SMN2RAB9A
SCHEMBL31040567 0.89 POLB (0.77) ALDH1A1POLBMAPTSMN1; SMN2RAB9A
SCHEMBL4554983 0.89 POLB (0.77) ALDH1A1POLBMAPTSMN1; SMN2RAB9A
SCHEMBL9504533 0.84 ALDH1A1 (0.61) ALDH1A1POLBMAPTSMN1; SMN2RAB9A
SCHEMBL13923626 0.84 SMN1; SMN2 (0.68) ALDH1A1POLBMAPTSMN1; SMN2RAB9A
SCHEMBL2755842 0.83 ALDH1A1 (0.77) ALDH1A1POLBMAPTSMN1; SMN2RAB9A
SCHEMBL23331399 0.82 ALDH1A1 (0.66) ALDH1A1POLBMAPTSMN1; SMN2RAB9A
SCHEMBL7759449 0.82 ALDH1A1 (0.66) ALDH1A1POLBMAPTSMN1; SMN2RAB9A
SCHEMBL19026947 0.81 ALDH1A1 (0.67) ALDH1A1POLBMAPTSMN1; SMN2HTT
SCHEMBL6850954 0.81 ALDH1A1 (0.71) ALDH1A1POLBMAPTSMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-4268680-A FUNGICIDES, BACTERICIDES JANSSEN PHARMACEUTICA N.V. (BE) 1981-05-19 US disclosed
US-4244964-A FUNGICIDES, BACTERICIDES JANSSEN PHARMACEUTICA N.V. (BE) 1981-01-13 US disclosed
US-4232034-A FUNGICIDES, BACTERICIDES JANSSEN PHARMACEUTICA, N.V. (BE) 1980-11-04 US disclosed
US-4229581-A FUNGICIDES, BACTERICIDES JANSSEN PHARMACEUTICA N.V. (BE) 1980-10-21 US disclosed
US-4229460-A FUNGICIDES, BACTERICIDES JANSSEN PHARMACEUTICA N.V. (BE) 1980-10-21 US disclosed
US-4160841-A FUNGICIDES, BACTERICIDES JANSSEN PHARMACEUTICA, N.V. (BE) 1979-07-10 US disclosed