SCHEMBL9025850

SCHEMBL9025850

CN=C(N)N(c1cc2ccccc2o1)c1cc(-c2ccc(Cl)cc2)ccc1OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HPGD P15428 4/20 0.36
TSHR P16473 4/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
ALOX15 P16050 1/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 3/20 0.36
HSD17B10 Q99714 3/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
ALDH1A1 P00352 2/20 0.35
TAAR1 Q96RJ0 1/20 0.35
ACLY P53396 3/20 0.35
NAMPT P43490 1/20 0.35
NPC1 O15118 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL9026261 0.92 TSHR (0.39) RAB9AMEN1KMT2AHPGDTSHR
SCHEMBL9026642 0.92 KMT2A (0.39) RAB9AMEN1KMT2AHPGDTSHR
SCHEMBL9026095 0.91 HPGD (0.43) RAB9AMEN1KMT2AHPGDTSHR
SCHEMBL9026398 0.90 KDM4E (0.39) RAB9AMEN1KMT2AHPGDTSHR
SCHEMBL9026454 0.88 PTGS2 (0.39) RAB9AMEN1KMT2AHPGDTSHR
SCHEMBL9026343 0.87 KDM4E (0.39) RAB9AMEN1KMT2AHPGDTSHR
SCHEMBL9025661 0.84 TSHR (0.46) RAB9AMEN1KMT2AHPGDTSHR
SCHEMBL9026419 0.84 HPGD (0.48) RAB9AMEN1KMT2AHPGDTSHR
SCHEMBL9024890 0.83 RAB9A (0.39) RAB9AMEN1KMT2AHPGDTSHR
SCHEMBL9026139 0.83 RAB9A (0.39) RAB9AMEN1KMT2AHPGDTSHR

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
EP-0711290-A1 METHYLGUANIDINE DERIVATIVES, METHODS FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1996-05-15 EP disclosed
WO-1995004052-A1 METHYLGUANIDINE DERIVATIVES, METHODS FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1995-02-09 WO disclosed