SCHEMBL6502603

SCHEMBL6502603

COC(=O)c1ccc2c(n1)nc(C)n2Cc1cc2nc(C)n(C)c2cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
RAB9A P51151 7/20 0.41
NPC1 O15118 6/20 0.41
MAPT P10636 5/20 0.41
LMNA P02545 2/20 0.41
DCTPP1 Q9H773 3/20 0.40
PPARG P37231 2/20 0.38
POLB P06746 1/20 0.38
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
BRD4 O60885 1/20 0.36
MEN1 O00255 1/20 0.35

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
SCHEMBL6503987 0.87 KDM4E (0.41) KDM4ERAB9ANPC1MAPTLMNA
SCHEMBL6299499 0.83 MAPT (0.38) KDM4ERAB9ANPC1MAPTLMNA
SCHEMBL6301746 0.83 PPARG (0.45) RAB9AMAPTLMNADCTPP1PPARG
SCHEMBL6299634 0.83 MAPT (0.39) KDM4ERAB9ANPC1MAPTDCTPP1
SCHEMBL6501381 0.82 KMT2A (0.40) KDM4ERAB9ANPC1MAPTDCTPP1
SCHEMBL6306001 0.81 MAPT (0.40) KDM4EMAPTLMNADCTPP1POLB
SCHEMBL6299003 0.81 MAPT (0.52) KDM4EMAPTLMNAKMT2AMEN1
SCHEMBL6301336 0.81 ABL1 (0.44) KDM4ERAB9ANPC1MAPTDCTPP1
SCHEMBL6306166 0.81 PLA2G2A (0.43) KDM4ERAB9ANPC1MAPTLMNA
SCHEMBL6300120 0.81 MAPT (0.38) KDM4ERAB9ANPC1MAPTLMNA

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 KDM4E 1599/4885RAB9A 2833/4885NPC1 4422/4885

“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.