SCHEMBL7040319

SCHEMBL7040319

COc1ccc(C(=S)c2ccc(Nc3cncc4ccccc34)cc2Cl)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
POLB P06746 2/20 0.42
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP11B1 P15538 3/20 0.41
CYP11B2 P19099 3/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP17A1 P05093 1/20 0.41
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
ADRA1A P35348 1/20 0.40
RAB9A P51151 2/20 0.40
ACP1 P24666 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL7039283 0.89 CYP11B1 (0.41) MAPTTP53SMN1; SMN2CYP11B1CYP11B2
SCHEMBL7035635 0.89 MAPK13 (0.52) MAPTPOLBTP53SMN1; SMN2CYP11B1
SCHEMBL7034065 0.88 MAPK14 (0.49) MAPTSMN1; SMN2LMNAALDH1A1ADRA2A
SCHEMBL7030779 0.87 ADRA2A (0.44) MAPTSMN1; SMN2LMNAALDH1A1ADRA2A
SCHEMBL7032158 0.87 MAPT (0.41) MAPTPOLBTP53SMN1; SMN2CYP11B1
SCHEMBL7033598 0.86 MAPK14 (0.48) MAPTSMN1; SMN2CYP11B1CYP11B2ALDH1A1
SCHEMBL7035323 0.83 ADRA2A (0.43) MAPTSMN1; SMN2ALDH1A1ADRA2AADRA2B
SCHEMBL7515617 0.81 TRPV1 (0.40) MAPTSMN1; SMN2LMNAALDH1A1ADRA2A
SCHEMBL7035912 0.79 CYP11B1 (0.41) MAPTPOLBTP53SMN1; SMN2CYP11B1
SCHEMBL7082009 0.78 ADRA2A (0.43) MAPTPOLBTP53SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1289958-A2 BENZOPHENONES AS INHIBITORS OF IL-1$g(b) AND TNF-$g(a) Leo Pharma A/S (DK) 2003-03-12 EP claimed
US-6432962-B2 Benzophenones as inhibitors of IL-1β and TNF-α LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2002-08-13 US claimed
US-20020016347-A1 Benzophenones as inhibitors of IL-1beta and TNF-alpha LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2002-02-07 US claimed
WO-2001090074-A2 BENZOPHENONES AS INHIBITORS OF IL-1β AND TNF-$g(a) LEO PHARMA A/S (DK) 2001-11-29 WO claimed
EP-1289958-A2 BENZOPHENONES AS INHIBITORS OF IL-1$g(b) AND TNF-$g(a) Leo Pharma A/S (DK) 2003-03-12 EP disclosed
EP-1052541-B1 Scratch resistant-water resistant overcoat for photographic systems EASTMAN KODAK CO (US) 2002-12-18 EP disclosed
US-6432962-B2 Benzophenones as inhibitors of IL-1β and TNF-α LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2002-08-13 US disclosed
US-20020016347-A1 Benzophenones as inhibitors of IL-1beta and TNF-alpha LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2002-02-07 US disclosed
WO-2001090074-A2 BENZOPHENONES AS INHIBITORS OF IL-1β AND TNF-$g(a) LEO PHARMA A/S (DK) 2001-11-29 WO disclosed
EP-1052541-A2 Scratch resistant-water resistant overcoat for photographic systems EASTMAN KODAK COMPANY (US) 2000-11-15 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-20020016347-A1 Benzophenones as inhibitors of IL-1beta and TNF-alpha IL1B, IL1A, NFKBIA MAPT 2961/4885POLB 1040/4885TP53 2032/4885

“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.