SCHEMBL5174693

SCHEMBL5174693

Cc1c(Cl)cccc1C(=O)c1ccc([N+](=O)[O-])cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.56
MAPK1 P28482 2/20 0.55
HTT P42858 2/20 0.55
GAA P10253 2/20 0.55
NPSR1 Q6W5P4 1/20 0.55
MAPT P10636 6/20 0.52
TDP1 Q9NUW8 2/20 0.52
POLB P06746 2/20 0.52
RAB9A P51151 5/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
LMNA P02545 1/20 0.49
NPC1 O15118 4/20 0.48
RORC P51449 1/20 0.48
ALDH1A1 P00352 1/20 0.47
MEN1 O00255 1/20 0.47
MCL1 Q07820 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL5174130 0.88 KMT2A (0.52) KMT2AMAPK1HTTGAANPSR1
SCHEMBL5173228 0.84 MAPK13 (0.61) KMT2AMAPK1HTTGAANPSR1
SCHEMBL7039277 0.80 GAA (0.61) KMT2AMAPK1HTTGAANPSR1
SCHEMBL30215953 0.80 KMT2A (0.55) KMT2AMAPK1HTTGAANPSR1
SCHEMBL5172484 0.79 MAPK1 (0.60) KMT2AMAPK1HTTGAANPSR1
SCHEMBL10902732 0.78 MAPK1 (0.63) KMT2AMAPK1HTTGAANPSR1
SCHEMBL11080512 0.78 MAPT (0.51) KMT2AGAAMAPTPOLBLMNA
SCHEMBL30215954 0.78 KMT2A (0.64) KMT2AMAPK1HTTGAANPSR1
SCHEMBL9383327 0.78 RORC (0.61) KMT2AMAPK1GAANPSR1MAPT
SCHEMBL5175977 0.78 KMT2A (0.56) KMT2AMAPK1HTTGAANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1237845-B1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1BETA AND TNF-ALPHA LEO PHARMA AS (DK) 2007-05-23 EP disclosed
US-6541670-B2 Antiinflammatory agents LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2003-04-01 US disclosed
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
US-20030013770-A1 Aminobenzophenones as inhibitors of il 1b and tnf LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2003-01-16 US disclosed
EP-1237845-A1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1BETA AND TNF-ALPHA LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 2002-09-11 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-$g(a) LEO PHARMA A/S (DK) 2001-11-29 WO disclosed
WO-2001042189-A1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1β AND TNF-$g(a) LEO PHARMA A/S (DK) 2001-06-14 WO 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 (2 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 KMT2A 4565/4885MAPK1 213/4885HTT 3842/4885
US-20030013770-A1 Aminobenzophenones as inhibitors of il 1b and tnf IL1B, IL1A, IL6 KMT2A 3848/4885MAPK1 228/4885HTT 2965/4885

“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.