SCHEMBL6503427

SCHEMBL6503427

Cc1nc2c(Cl)c(CO)ccc2n1C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.38
CYP2C19 P33261 3/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2D6 P10635 1/20 0.38
KMT2A Q03164 3/20 0.37
RAB9A P51151 8/20 0.36
NPC1 O15118 7/20 0.36
MAPT P10636 3/20 0.35
RORC P51449 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.32
MEN1 O00255 2/20 0.31
WEE1 P30291 1/20 0.31
HDAC1 Q13547 1/20 0.30

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
SCHEMBL6492669 0.85 CYP1A2 (0.38) CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6
SCHEMBL26923166 0.75 CYP1A2 (0.37) CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6
SCHEMBL614873 0.75 CYP1A2 (0.37) CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6
SCHEMBL16806045 0.70 CYP1A2 (0.39) CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6
SCHEMBL22245576 0.70 KDM4E (0.35) CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6
SCHEMBL6498261 0.70 PIK3CB (0.37) KMT2ARAB9ANPC1MAPTALDH1A1
SCHEMBL6502331 0.70 NPC1 (0.43) RAB9ANPC1MAPTKDM4EALDH1A1
SCHEMBL5901254 0.69 RAB9A (0.39) CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6
SCHEMBL6501812 0.68 KDM4E (0.47) CYP1A2CYP2C19KMT2ARAB9ANPC1
SCHEMBL3295739 0.67 CYP1A2 (0.49) CYP1A2CYP2C19CYP3A4CYP2C9CYP2D6

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
US-6890934-B2 Sulfonamide compounds and uses thereof as medicines FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-05-10 US disclosed
US-20030171396-A1 Sulfonamide compounds and uses thereof as medicines FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2003-09-11 US disclosed
US-6573274-B1 Treatment of the diseases curable based on a hypoglycemic action, and the diseases curable based on a cGMP-PDE inhibitory action, a smooth muscle relaxing action, a bronchodilating action, a vasodilating action, a smooth muscle FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2003-06-03 US disclosed
EP-1136492-A1 SULFONAMIDE COMPOUNDS AND USES THEREOF AS MEDICINES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-09-26 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030171396-A1 Sulfonamide compounds and uses thereof as medicines PDE2A, PDE3A, PDE5A CYP1A2 1033/4885CYP2C19 764/4885CYP3A4 1384/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.