SCHEMBL11067896

SCHEMBL11067896

S=C(Nc1ccc(Cl)cc1)Nc1cccc(Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.78
MEN1 O00255 2/20 0.78
KMT2A Q03164 2/20 0.78
MAOA P21397 1/20 0.78
MAOB P27338 1/20 0.78
IDO1 P14902 1/20 0.69
MAPT P10636 2/20 0.65
GAA P10253 1/20 0.65

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
SCHEMBL26991 0.92 IDO1 (0.79) ALDH1A1MEN1KMT2AMAOAMAOB
SCHEMBL29481122 0.92 IDO1 (0.79) ALDH1A1MEN1KMT2AMAOAMAOB
SCHEMBL5454961 0.91 MAOB (0.75) ALDH1A1MEN1KMT2AMAOAMAOB
SCHEMBL16566455 0.88 MAOB (1.00) ALDH1A1MEN1KMT2AMAOAMAOB
SCHEMBL16566457 0.88 MEN1 (0.71) ALDH1A1MEN1KMT2AMAOAMAOB
SCHEMBL6811430 0.88 MEN1 (0.71) ALDH1A1MEN1KMT2AMAOAMAOB
SCHEMBL16566494 0.86 ALDH1A1 (0.71) ALDH1A1MEN1KMT2AMAOAMAOB
SCHEMBL6815121 0.85 ALDH1A1 (0.70) ALDH1A1MEN1KMT2AMAOAMAOB
SCHEMBL22274845 0.85 IDO1 (0.73) ALDH1A1MEN1KMT2AMAOAMAOB
SCHEMBL16566470 0.84 MEN1 (0.77) ALDH1A1MEN1KMT2AMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150080580-A1 THIOUREA DERIVATIVES AS a-CHYMOTRYPSIN INHIBITORS RAHMAN ATTA-UR (PK) 2015-03-19 US disclosed
US-20150080580-A1 THIOUREA DERIVATIVES AS a-CHYMOTRYPSIN INHIBITORS RAHMAN ATTA-UR (PK) 2015-03-19 US disclosed
US-4461821-A Photoconductive compositions and electrophotographic photosensitive materials comprising an organic photoconductor and a thiourea compound FUJI PHOTO FILM CO., LTD. (JP) 1984-07-24 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-20150080580-A1 THIOUREA DERIVATIVES AS a-CHYMOTRYPSIN INHIBITORS SERPINB1, CTRL, RNASE1 ALDH1A1 1629/4885MEN1 4431/4885KMT2A 2472/4885

“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.