SCHEMBL8318642

SCHEMBL8318642

C=CCc1nc(SC)nc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.50
LMNA P02545 7/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
HTT P42858 2/20 0.50
ALDH1A1 P00352 6/20 0.49
MAPT P10636 5/20 0.49
L3MBTL1 Q9Y468 4/20 0.49
TDP1 Q9NUW8 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
HPGD P15428 2/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP3A4 P08684 1/20 0.41
GAA P10253 1/20 0.39
HSP90AA1 P07900 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HSP90AB1 P08238 1/20 0.37

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
SCHEMBL1415779 0.76 KMT2A (0.58) KDM4ELMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL15882934 0.76 KDM4E (0.37) KDM4ELMNASMN1; SMN2HTTALDH1A1
SCHEMBL28754732 0.76 KDM4E (0.38) KDM4ELMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL28018343 0.71 NPY5R (0.59) KDM4ESMN1; SMN2HTTMAPTNPSR1
SCHEMBL24175003 0.71 KDM4E (0.61) KDM4ELMNASMN1; SMN2HTTALDH1A1
SCHEMBL8325338 0.71 KDM4E (0.74) KDM4ELMNASMN1; SMN2HTTALDH1A1
SCHEMBL29532939 0.71 KDM4E (0.74) KDM4ELMNASMN1; SMN2HTTALDH1A1
SCHEMBL31392367 0.69 KDM4E (0.59) KDM4ELMNASMN1; SMN2HTTALDH1A1
SCHEMBL8483152 0.69 KDM4E (0.59) KDM4ELMNASMN1; SMN2HTTALDH1A1
SCHEMBL3816236 0.69 KDM4E (0.59) KDM4ELMNASMN1; SMN2HTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0594883-B1 Imidazo(1,2-c) quinazoline derivatives as antihypertensives and anti dysurics NAT SCIENCE COUNCIL (TW) 1999-01-27 EP disclosed
US-5512677-A TREATING HYPERTENSION, DYSURIA NATIONAL SCIENCE COUNCIL (TW) 1996-04-30 US disclosed
US-5340814-A Hypotensive agents NATIONAL SCIENCE COUNCIL (TW) 1994-08-23 US disclosed
EP-0594883-A1 Imidazo(1,2-c) quinazoline derivatives as antihypertensives and anti dysurics NATIONAL SCIENCE COUNCIL (TW) 1994-05-04 EP disclosed