SCHEMBL12424543

SCHEMBL12424543

CC(=O)Nc1cc2c(cc1N=O)CCC2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BAZ2B Q9UIF8 1/20 0.41
▸ MAPT P10636 4/20 0.38
▸ NPC1 O15118 8/20 0.36
▸ HTT P42858 1/20 0.36
▸ RAB9A P51151 7/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ POLB P06746 3/20 0.36
▸ MAOA P21397 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ NLRP3 Q96P20 1/20 0.34
▸ NEU3 Q9UQ49 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ NFKB2 Q00653 1/20 0.34
▸ RELA Q04206 1/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ SENP7 Q9BQF6 1/20 0.34

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
SCHEMBL12364939 0.95 BAZ2B (0.40) BAZ2BMAPTNPC1HTTRAB9A
SCHEMBL12365892 0.81 KDM4E (0.43) MAPTNPC1RAB9ASMN1; SMN2POLB
SCHEMBL12364375 0.81 NPC1 (0.35) MAPTNPC1HTTRAB9APOLB
SCHEMBL12424546 0.78 BAZ2B (0.43) BAZ2BMAPTNPC1HTTRAB9A
SCHEMBL19995853 0.77 ALDH1A1 (0.44) BAZ2BMAPTNPC1HTTRAB9A
SCHEMBL12365761 0.77 KDM4E (0.46) MAPTNPC1RAB9ASMN1; SMN2POLB
SCHEMBL3827983 0.76 PGK1 (0.48) BAZ2BMAPTNPC1HTTRAB9A
SCHEMBL433839 0.76 CA1 (0.45) BAZ2BMAPTNPC1HTTRAB9A
SCHEMBL22827947 0.76 NLRP3 (0.53) BAZ2BMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL30951184 0.76 PGK1 (0.48) BAZ2BMAPTNPC1HTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338487-B2 Substituted arylamino-1,2,3,4-tetrahydro naphthalenes and -2,3-dihydro-1H-indenes as potassium channel modulators VALEANT PHARMACEUTICALS INTERNATIONAL, INC. (US) 2012-12-25 — — US disclosed
US-20110207812-A1 SUBSTITUTED ARYLAMINO-1,2,3,4-TETRAHYDRO NAPHTHALENES AND -2,3-DIHYDRO-1H-INDENES AS POTASSIUM CHANNEL MODULATORS ORAPHARMA, INC. 2011-08-25 — — US disclosed
US-7960436-B2 Therapy and prophylaxis of diseases and disorders such as seizure disorders; [1-Amino-5-(4-trifluoromethyl-phenylamino)-5,6,7,8-tetrahydro-naphthalen-2-yl]-carbamic acid ethyl ester VALEANT PHARMACEUTICALS INTERNATIONAL (US) 2011-06-14 — — US disclosed
US-20080146661-A1 Substituted arylamino -1,2,3,4-tetrahydro naphthalenes and -2,3-dihydro-1H-indenes as potassium channel modulators VALEANT PHARMACEUTICALS NORTH AMERICA (US) 2008-06-19 — — 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 (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-20110207812-A1 SUBSTITUTED ARYLAMINO-1,2,3,4-TETRAHYDRO NAPHTHALENES AND -2,3-DIHYDRO-1H-INDENES AS POTASSIUM CHANNEL MODULATORS SCN1B, SCN1A, SCN4A BAZ2B 1954/4885MAPT 3337/4885NPC1 329/4885
US-20080146661-A1 Substituted arylamino -1,2,3,4-tetrahydro naphthalenes and -2,3-dihydro-1H-indenes as potassium channel modulators SCN1B, SCN1A, SCN4A BAZ2B 1807/4885MAPT 3170/4885NPC1 326/4885

“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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