SCHEMBL2173463

SCHEMBL2173463

C1=C(c2ccncc2)CCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.51
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
ACMSD Q8TDX5 2/20 0.42
TDP1 Q9NUW8 1/20 0.41
PSMB5 P28074 3/20 0.40
MAPK14 Q16539 1/20 0.39
PPARA Q07869 1/20 0.38
CYP3A4 P08684 2/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
JAK3 P52333 1/20 0.38
CSF1R P07333 1/20 0.38
CYP2C9 P11712 1/20 0.38
NOTUM Q6P988 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37

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
SCHEMBL10793933 0.83 ACMSD (0.53) ACMSDTDP1PSMB5CYP3A4JAK2
SCHEMBL27359997 0.80 MAPT (0.53) LMNAMAPTMAPK14CYP3A4CYP2C9
SCHEMBL2171290 0.78 PPARA (0.57) LMNAMAPTTDP1PPARACYP3A4
SCHEMBL17721315 0.77 PPARA (0.56) LMNAMAPTTDP1PPARACYP3A4
SCHEMBL191429 0.76 ACMSD (0.49) ACMSDTDP1SIGMAR1PTGS2
SCHEMBL8380044 0.76 ACMSD (0.49) ACMSDTDP1SIGMAR1PTGS2
SCHEMBL12879148 0.75 ADRB2 (0.46) KDRACMSDTDP1PSMB5PPARA
SCHEMBL16188025 0.75 PSMB5 (0.46) KDRACMSDTDP1PSMB5CASP3
SCHEMBL15465713 0.75 HDAC1 (0.43) KDRACMSDTDP1PSMB5JAK2
SCHEMBL27572022 0.75 ACMSD (0.42) KDRACMSDTDP1PSMB5JAK2

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4649202-A Brominative aromatization of 4-cyclohexenylpyridines ETHYL CORPORATION (US) 1987-03-10 US claimed
EP-4141980-A1 ORGANIC LIGHT EMITTING DIODE AND A COMPOUND FOR USE THEREIN Novaled GmbH (DE) 2023-03-01 EP disclosed
US-9458155-B2 Pyrido[4,3-b]indoles containing rigid moieties MEDIVATION TECHNOLOGIES, INC (US) 2016-10-04 US disclosed
US-9458155-B2 Pyrido[4,3-b]indoles containing rigid moieties MEDIVATION TECHNOLOGIES, INC (US) 2016-10-04 US disclosed
US-9458155-B2 Pyrido[4,3-b]indoles containing rigid moieties MEDIVATION TECHNOLOGIES, INC (US) 2016-10-04 US disclosed
US-20150051218-A1 PYRIDO[4,3-B]INDOLES CONTAINING RIGID MOIETIES MEDIVATION TECHNOLOGIES, INC. 2015-02-19 US disclosed
US-20150051218-A1 PYRIDO[4,3-B]INDOLES CONTAINING RIGID MOIETIES MEDIVATION TECHNOLOGIES, INC. 2015-02-19 US disclosed
US-20150051218-A1 PYRIDO[4,3-B]INDOLES CONTAINING RIGID MOIETIES MEDIVATION TECHNOLOGIES, INC. 2015-02-19 US disclosed
US-8906925-B2 Pyrido[4,3-B]indoles containing rigid moieties MEDIVATION TECHNOLOGIES, INC. (US) 2014-12-09 US disclosed
US-8906925-B2 Pyrido[4,3-B]indoles containing rigid moieties MEDIVATION TECHNOLOGIES, INC. (US) 2014-12-09 US disclosed
WO-2010051501-A1 PYRIDO (4,3-B) INDOLES CONTAINING RIGID MOIETIES MEDIVATION TECHNOLOGIES, INC. (US) 2010-05-06 WO disclosed
WO-2010051501-A1 PYRIDO (4,3-B) INDOLES CONTAINING RIGID MOIETIES MEDIVATION TECHNOLOGIES, INC. (US) 2010-05-06 WO disclosed
CN-1335836-A Tricyclic pyrazole derivatives BASF AG (DE) 2002-02-13 CN disclosed
US-4727148-A Certain aromatization process for preparing 1-alkyl-1,4-dihydro-4-oxo-7-(4-pyridyl)-3-quinoline carboxylic acid ETHYL CORPORATION (US) 1988-02-23 US disclosed
US-4727148-A Certain aromatization process for preparing 1-alkyl-1,4-dihydro-4-oxo-7-(4-pyridyl)-3-quinoline carboxylic acid ETHYL CORPORATION (US) 1988-02-23 US disclosed
US-4649202-A Brominative aromatization of 4-cyclohexenylpyridines ETHYL CORPORATION (US) 1987-03-10 US disclosed
US-4649202-A Brominative aromatization of 4-cyclohexenylpyridines ETHYL CORPORATION (US) 1987-03-10 US disclosed
US-4649202-A Brominative aromatization of 4-cyclohexenylpyridines ETHYL CORPORATION (US) 1987-03-10 US disclosed
US-4604467-A Certain 4-(3,4-dibromocyclohexyl)pyridines ETHYL CORPORATION (US) 1986-08-05 US disclosed
US-4604467-A Certain 4-(3,4-dibromocyclohexyl)pyridines ETHYL CORPORATION (US) 1986-08-05 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-20150051218-A1 PYRIDO[4,3-B]INDOLES CONTAINING RIGID MOIETIES HTR3B, HTR3D, HTR3A KDR 4310/4885LMNA 3212/4885MAPT 204/4885

“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.