SCHEMBL7950899

SCHEMBL7950899

O=C1NC(=O)N(c2cc(Cl)ccc2O)C1c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
QPCT Q16769 4/20 0.43
ATM Q13315 1/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
KCNMA1 Q12791 2/20 0.38
SLC6A3 Q01959 1/20 0.37
TP53 P04637 6/20 0.37
MDM2 Q00987 4/20 0.37
MAPT P10636 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL7950814 0.81 ALDH1A1 (0.45) QPCTMEN1KMT2ATP53MDM2
SCHEMBL9843082 0.71 QPCT (0.57) CYP1A2CYP2C19QPCTMEN1KMT2A
SCHEMBL11415790 0.70 QPCT (0.54) QPCTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL3583000 0.70 QPCT (0.49) QPCTSLC6A3MDM2LMNAMMP2
SCHEMBL3582993 0.70 QPCT (0.49) QPCTSLC6A3MDM2LMNAMMP2
SCHEMBL3589146 0.70 QPCT (0.49) QPCTSLC6A3MDM2LMNAMMP2
SCHEMBL10524889 0.69 QPCT (0.44) CYP3A4CYP2C19QPCTMEN1KMT2A
SCHEMBL4565683 0.69 QPCT (0.48) QPCTMEN1KMT2AMDM2LMNA
SCHEMBL11663424 0.67 MEN1 (0.54) CYP1A2CYP2C19ATMMEN1KMT2A
SCHEMBL11405716 0.66 QPCT (0.52) CYP1A2CYP3A4CYP2D6CYP2C19QPCT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6271249-B1 Diphenyl imidazoles as potassium channel modulators BRISTOL-MYERS SQUIBB COMPANY 2001-08-07 US disclosed
US-6077861-A MODULATORS OF THE LARGE-CONDUCTANCE CALCIUM-ACTIVATED POTASSIUM (BK) CHANNELS, THEREFORE, USEFUL IN THE TREATMENT OF ISCHEMIC STROKE BRISTOL-MYERS SQUIBB COMPANY (US) 2000-06-20 US disclosed
US-5869509-A TREAT DISORDERS RESPONSIVE TO OPENERS OF THE LARGE CONDUCTANCE CALCIUM-ACTIVATED POTASSIUM CHANNELS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-02-09 US disclosed