SCHEMBL835524

SCHEMBL835524

CCSCc1ccc(Br)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ LMNA P02545 1/20 0.47
▸ IDO1 P14902 2/20 0.47
▸ EPHX1 P07099 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ TAAR1 Q96RJ0 3/20 0.40
▸ MAOB P27338 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ HTR2A P28223 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
SCHEMBL20734753 0.87 IDO1 (0.39) MEN1KMT2ALMNAIDO1ALDH1A1
SCHEMBL8011467 0.85 MEN1 (0.54) MEN1KMT2ALMNAEPHX1MAPK1
SCHEMBL9344493 0.85 MEN1 (0.61) MEN1KMT2ALMNAIDO1EPHX1
SCHEMBL13799444 0.82 MEN1 (0.50) MEN1KMT2ALMNAIDO1EPHX1
SCHEMBL20806989 0.80 BCHE (0.44) IDO1TAAR1
SCHEMBL14443894 0.79 CYP1A2 (0.49) MEN1KMT2ALMNAIDO1EPHX1
SCHEMBL12337765 0.78 IDO1 (0.48) LMNAIDO1ALDH1A1RAB9ATAAR1
SCHEMBL9342625 0.78 MEN1 (0.55) MEN1KMT2ALMNAIDO1EPHX1
SCHEMBL8007514 0.76 APP (0.44) IDO1
SCHEMBL10062558 0.76 CYP1A2 (0.50) MEN1KMT2ALMNAIDO1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120252770-A1 Chemical Compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-10-04 — — US disclosed
EP-2102169-B1 INDAZOLYL AMIDE DERIVATIVES FOR THE TREATMENT OF GLUCOCORTICOID RECEPTOR MEDIATED DISORDERS ASTRAZENECA AB (SE) 2012-06-20 — — EP disclosed
US-8143290-B2 Chemical compounds 572 ASTRAZENECA AB (SE) 2012-03-27 — — US disclosed
US-20110071194-A1 Chemical Compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-03-24 — — US disclosed
US-20100197644-A1 Chemical Compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2010-08-05 — — US disclosed
US-7728030-B2 Chemical compounds 572 ASTRAZENECA AB (SE) 2010-06-01 — — US disclosed
EP-2102169-A1 INDAZOLYL ESTER AND AMIDE DERIVATIVES FOR THE TREATMENT OF GLUCOCORTICOID RECEPTOR MEDIATED DISORDERS AstraZeneca AB (SE) 2009-09-23 — — EP disclosed
US-20080214641-A1 Chemical compounds 572 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2008-09-04 — — US disclosed
WO-2008076048-A1 INDAZOLYL ESTER AND AMIDE DERIVATIVES FOR THE TREATMENT OF GLUCOCORTICOID RECEPTOR MEDIATED DISORDERS ASTRAZENECA AB (SE) 2008-06-26 — — WO disclosed
US-6077866-A EXHIBIT POWERFUL INSECTICIDAL ACTION, ESPECIALLY AGAINST LEPIDOPTERA, COLEOPTERA AND SOIL INSECTS NIHON BAYER AGROCHEM K.K. (JP) 2000-06-20 — — US disclosed
EP-0742202-B1 Benzophenone hydrazone derivatives as insecticides BAYER AGROCHEM KK (JP) 1999-12-01 — — EP disclosed
EP-0742202-A2 Benzophenone hydrazone derivatives as insecticides NIHON BAYER AGROCHEM K.K. (JP) 1996-11-13 — — 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 (4 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-20080214641-A1 Chemical compounds 572 ABCG2, ABCB1, CYP11B2 MEN1 1522/4885KMT2A 4171/4885LMNA 1618/4885
US-20100197644-A1 Chemical Compounds 572 ABCG2, ABCB1, CYP11B2 MEN1 1522/4885KMT2A 4171/4885LMNA 1618/4885
US-20120252770-A1 Chemical Compounds 572 ABCG2, ABCB1, CYP11B2 MEN1 1522/4885KMT2A 4171/4885LMNA 1618/4885
US-20110071194-A1 Chemical Compounds 572 ABCG2, ABCB1, CYP11B2 MEN1 1522/4885KMT2A 4171/4885LMNA 1618/4885

“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.

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