SCHEMBL7325111

SCHEMBL7325111

CC(=O)Oc1ccc(/C=C/C(=O)Oc2ccc(C(=N)N)cc2C(=O)c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.51
▸ ELANE P08246 1/20 0.46
▸ MAPT P10636 5/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.45
▸ KDM4E B2RXH2 4/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ PLG P00747 1/20 0.41
▸ PLAU P00749 1/20 0.41
▸ PLAT P00750 1/20 0.41
▸ KLK1 P06870 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TTR P02766 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ GAA P10253 1/20 0.41

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
SCHEMBL7325116 1.00 KMT2A (0.51) KMT2AELANEMAPTMAPK1SMN1; SMN2
SCHEMBL7322271 0.95 KMT2A (0.47) KMT2AELANEMAPTMAPK1SMN1; SMN2
SCHEMBL7320565 0.82 MAPT (0.54) ELANEMAPTMAPK1KDM4EALDH1A1
SCHEMBL7328267 0.78 KMT2A (0.50) KMT2AELANEMAPTMAPK1SMN1; SMN2
SCHEMBL3362024 0.77 KMT2A (0.68) KMT2AMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL3362022 0.77 KMT2A (0.68) KMT2AMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL7333700 0.77 ELANE (0.41) ELANEMAPTMAPK1KDM4EKLK1
SCHEMBL7333102 0.77 MAPT (0.48) KMT2AELANEMAPTMAPK1KDM4E
SCHEMBL7323689 0.76 TNFRSF1A (0.64) KMT2AMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL7323696 0.76 TNFRSF1A (0.64) KMT2AMAPTSMN1; SMN2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4570006-A ANTITHROMBIN; ENZYME AND HORMONE INHIBITORS TORII & CO. LTD. (JP) 1986-02-11 — — US disclosed
US-4514416-A Amidine compound, process for producing same and anti-complement agent comprising same TORII & CO. LTD. (JP) 1985-04-30 — — US disclosed
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