SCHEMBL8701559

SCHEMBL8701559

Cc1ccc(C)n1-c1cccc(C(=O)NC(=N)N)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.60
MAPT P10636 5/20 0.59
ALDH1A1 P00352 5/20 0.59
POLB P06746 3/20 0.59
MEN1 O00255 2/20 0.59
ALOX15 P16050 2/20 0.59
KMT2A Q03164 2/20 0.59
NR4A1 P22736 2/20 0.59
MYC P01106 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
USP2 O75604 1/20 0.59
HSPA1A P0DMV8 1/20 0.59
GAA P10253 1/20 0.59
PTPN7 P35236 1/20 0.59
RECQL P46063 1/20 0.59
BLM P54132 1/20 0.59
HSD17B10 Q99714 1/20 0.59
SMN1; SMN2 Q16637 3/20 0.50
PKM P14618 1/20 0.47

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
SCHEMBL8706283 0.84 KDM4E (0.45) KDM4EMAPTALDH1A1POLBMEN1
SCHEMBL8703968 0.83 AOC2 (0.42) KDM4EMAPTALDH1A1POLBMEN1
SCHEMBL17172446 0.82 KDM4E (0.67) KDM4EMAPTALDH1A1POLBMEN1
Hydrochloric Acid SCHEMBL8703585 0.82 AOC2 (0.41) KDM4EMAPTALDH1A1POLBMEN1
SCHEMBL16720590 0.81 KDM4E (0.74) KDM4EMAPTALDH1A1POLBMEN1
Hydrochloric Acid SCHEMBL8705820 0.81 AOC2 (0.42) KDM4EMAPTALDH1A1POLBMEN1
SCHEMBL8705516 0.79 AOC2 (0.68) MAPTALDH1A1MEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL8700020 0.78 AOC2 (0.66) MAPTALDH1A1MEN1KMT2ATDP1
SCHEMBL8705529 0.77 AOC2 (0.59) ALDH1A1POLBMEN1KMT2ATDP1
SCHEMBL8699862 0.76 AOC2 (0.42) KDM4EMAPTPOLBMEN1KMT2A

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
US-5824691-A CARDIOVASCULAR, CEREBROVASCULAR, RENAL DISEASES; SHOCK, ARTERIOSCLEROSIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-10-20 US disclosed