SCHEMBL7846427

SCHEMBL7846427

Cc1nc2ccc(N)cc2[nH]1.Nc1ccc(NC=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.56
ALDH1A1 P00352 9/20 0.56
KDM4E B2RXH2 9/20 0.56
MEN1 O00255 8/20 0.56
KMT2A Q03164 8/20 0.56
POLB P06746 7/20 0.56
RAB9A P51151 6/20 0.56
GAA P10253 6/20 0.56
NPC1 O15118 4/20 0.56
GFER P55789 4/20 0.56
GLA P06280 4/20 0.56
RXFP1 Q9HBX9 3/20 0.56
HPGD P15428 6/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
RECQL P46063 3/20 0.46
TDP1 Q9NUW8 3/20 0.43
PKM P14618 3/20 0.43
BLM P54132 3/20 0.43
HSD17B10 Q99714 2/20 0.43
USP2 O75604 2/20 0.43

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
SCHEMBL7784359 0.89 POLB (0.47) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL1925827 0.82 MAPT (0.76) MAPTALDH1A1KDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL8990129 0.81 MAPT (0.73) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL393991 0.72 ALDH1A1 (0.56) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL6625448 0.71 ALDH1A1 (0.56) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL12109509 0.70 ALDH1A1 (0.58) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL7783498 0.69 PRKCI (0.49) MAPTALDH1A1KDM4EKMT2APOLB
SCHEMBL1925825 0.69 KDM4E (0.57) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL21788566 0.69 MEN1 (0.86) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL4230805 0.68 ALDH1A1 (0.56) MAPTALDH1A1KDM4EMEN1KMT2A

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-1137647-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
WO-2000034268-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed