SCHEMBL3786387

SCHEMBL3786387

CC(=O)Nc1ccc(NC(C)=O)c(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA9 Q16790 1/20 0.58
RORC P51449 6/20 0.57
SMN1; SMN2 Q16637 1/20 0.55
MAPT P10636 2/20 0.53
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
ALDH1A1 P00352 3/20 0.51
TNIK Q9UKE5 1/20 0.51
ESRRA P11474 1/20 0.50
NPC1 O15118 1/20 0.50
CASP3 P42574 1/20 0.50
RAB9A P51151 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50

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
SCHEMBL6819492 0.90 ALDH1A1 (0.62) CA1CA2CA9SMN1; SMN2MAPT
SCHEMBL11642217 0.85 MEN1 (0.54) CA1CA2CA9RORCSMN1; SMN2
SCHEMBL3461025 0.85 KMT2A (0.65) SMN1; SMN2MAPTMEN1KMT2AALDH1A1
SCHEMBL3791892 0.85 ALDH1A1 (0.60) RORCSMN1; SMN2MAPTMEN1KMT2A
SCHEMBL4548035 0.84 EPHX1 (0.70) CA2CA9RORCSMN1; SMN2MAPT
SCHEMBL10201340 0.83 CA1 (0.57) CA1CA2CA9SMN1; SMN2MAPT
SCHEMBL6811020 0.83 ALDH1A1 (0.54) CA1CA2CA9MAPTMEN1
SCHEMBL7161458 0.83 GAA (0.58) SMN1; SMN2MAPTMEN1KMT2AALDH1A1
SCHEMBL29822237 0.82 KDM4E (0.66) CA1CA2CA9SMN1; SMN2ALDH1A1
SCHEMBL4311940 0.82 KDM4E (0.66) CA1CA2CA9SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101891632-B Preparation method of 2-chloro-5-nitro-1, 4-p-phenylenediamine OKEANOS TECH CO LTD 2012-04-25 CN disclosed
CN-101891632-A Preparation method of 2-chlorine-5-nitro-1,4-p-phenylenediamine OKEANOS TECH CO LTD 2010-11-24 CN disclosed
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 EP disclosed
US-3973900-A AMINO NITRO BENZENES WELLA AG (DT) 1976-08-10 US 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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 CA1 3273/4885CA2 1992/4885CA9 816/4885

“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.