SCHEMBL4701004

SCHEMBL4701004

COc1ccc(/C=N/NC(=N)NCCc2ccccc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.74
MEN1 O00255 5/20 0.74
TRPM5 Q9NZQ8 1/20 0.55
LMNA P02545 1/20 0.54
ALOX12 P18054 1/20 0.54
AURKA O14965 1/20 0.53
PLAAT3 P53816 1/20 0.53
PLAAT5 Q96KN8 1/20 0.53
PLAAT2 Q9NWW9 1/20 0.53
PLAAT4 Q9UL19 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
ALPL P05186 1/20 0.53
ALPI P09923 1/20 0.53
ALPG P10696 1/20 0.53
CYP1A2 P05177 1/20 0.52
MAPT P10636 1/20 0.52
MAPK1 P28482 1/20 0.52
POLB P06746 1/20 0.51
NPC1 O15118 1/20 0.51
GAA P10253 1/20 0.51

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
SCHEMBL4701009 1.00 KMT2A (0.74) KMT2AMEN1TRPM5LMNAALOX12
SCHEMBL4698438 0.81 LMNA (0.51) KMT2AMEN1TRPM5LMNAALOX12
SCHEMBL18251625 0.80 CYP1A2 (0.68) KMT2AMEN1LMNASMN1; SMN2CYP1A2
SCHEMBL4699811 0.79 MAPT (0.74) KMT2AMEN1LMNASMN1; SMN2MAPT
SCHEMBL4699516 0.79 MAPT (0.74) KMT2AMEN1LMNASMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL18245478 0.78 CYP1A2 (0.66) KMT2AMEN1LMNASMN1; SMN2CYP1A2
Hydrochloric Acid SCHEMBL18245477 0.78 CYP1A2 (0.66) KMT2AMEN1LMNASMN1; SMN2CYP1A2
SCHEMBL4701015 0.76 KMT2A (0.61) KMT2AMEN1LMNASMN1; SMN2CYP1A2
SCHEMBL13563559 0.74 MEN1 (0.58) KMT2AMEN1PLAAT3PLAAT5PLAAT2
SCHEMBL18251633 0.74 CYP1A2 (0.67) KMT2AMEN1LMNASMN1; SMN2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016198472-A1 TOPICAL DELIVERY SYSTEM HPF IP HOLDING S.A. (LU) 2016-12-15 WO claimed
EP-1309544-B1 COMPOUNDS ACTING AS MELANOCORTIN RECEPTOR LIGANDS ACURE PHARMA AB (SE) 2008-11-05 EP claimed
US-7153881-B2 Compounds acting as melanocortin receptor ligands ACURE PHARMA AB (SE) 2006-12-26 US claimed
WO-2016198472-A1 TOPICAL DELIVERY SYSTEM HPF IP HOLDING S.A. (LU) 2016-12-15 WO disclosed
WO-2015097513-A1 TOPICAL PRODUCTS FOR AMINOGUANIDINES ANAMAR DERMA AB (SE) 2015-07-02 WO disclosed
EP-1309544-B1 COMPOUNDS ACTING AS MELANOCORTIN RECEPTOR LIGANDS ACURE PHARMA AB (SE) 2008-11-05 EP disclosed
US-7153881-B2 Compounds acting as melanocortin receptor ligands ACURE PHARMA AB (SE) 2006-12-26 US disclosed