SCHEMBL10468239

SCHEMBL10468239

O=C(Oc1ccccc1)c1cccc(-n2nnnc2[S])c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.53
KMT2A Q03164 11/20 0.52
TP53 P04637 1/20 0.44
MAPT P10636 4/20 0.42
ALDH1A1 P00352 4/20 0.42
HPGD P15428 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
S1PR4 O95977 1/20 0.42
LMNA P02545 1/20 0.42
S1PR1 P21453 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MEN1 O00255 3/20 0.41
POLB P06746 1/20 0.41
NSD2 O96028 1/20 0.40
CPB1 P15086 1/20 0.40

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
SCHEMBL10467477 0.86 KMT2A (0.51) KMT2AMAPTALDH1A1HPGDHTT
SCHEMBL10467099 0.86 KMT2A (0.58) KMT2AMAPTALDH1A1TDP1LMNA
SCHEMBL6153223 0.85 MAPK1 (0.53) MAPK1KMT2ATP53MAPTALDH1A1
SCHEMBL10467466 0.75 TP53 (0.46) MAPK1KMT2ATP53MAPTALDH1A1
SCHEMBL9768540 0.73 TP53 (0.42) MAPK1KMT2ATP53MAPTALDH1A1
SCHEMBL69684 0.72 NSD2 (0.63) MAPK1KMT2AMAPTALDH1A1HPGD
Hydrochloric Acid SCHEMBL8094637 0.71 ALDH1A1 (0.52) KMT2AMAPTALDH1A1HPGDLMNA
SCHEMBL8673010 0.71 NSD2 (0.61) MAPK1KMT2AMAPTALDH1A1HPGD
SCHEMBL28168705 0.71 NSD2 (0.61) MAPK1KMT2AMAPTALDH1A1HPGD
SCHEMBL5605140 0.70 KMT2A (0.65) MAPK1KMT2ATP53MAPTALDH1A1

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-4950764-A HERBICIDES, BACTERICIDES, ANALGESICS, ANTIINFLAMMATORY AGENT FUJI PHOTO FILM CO., LTD. (JP) 1990-08-21 US disclosed