SCHEMBL2509723

SCHEMBL2509723

Clc1ccc2[nH]c3c(c2c1)CN1CCCC1C3

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 7/20 0.49
BAZ2B Q9UIF8 2/20 0.47
SIRT1 Q96EB6 1/20 0.47
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
HTR6 P50406 1/20 0.41
CTSK P43235 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
SCHEMBL12244099 0.90 SIRT1 (0.44) MCHR1BAZ2BSIRT1CNR2HTR6
SCHEMBL12480987 0.85 CNR1 (0.56) BAZ2BSIRT1CNR1CNR2CTSK
SCHEMBL2511193 0.85 L3MBTL1 (0.52) MCHR1BAZ2BCNR1CNR2
SCHEMBL17220795 0.85 L3MBTL1 (0.52) MCHR1BAZ2BCNR1CNR2
SCHEMBL17220782 0.85 MCHR1 (0.49) MCHR1BAZ2BCNR1CNR2
SCHEMBL2193204 0.82 BAZ2B (0.58) BAZ2BSIRT1CNR1HTR6CTSK
SCHEMBL17220778 0.81 MCHR1 (0.59) MCHR1CNR1CNR2CTSK
SCHEMBL1445490 0.81 L3MBTL1 (0.51) MCHR1BAZ2BCNR1CNR2
SCHEMBL1445526 0.80 MCHR1 (0.42) MCHR1CNR1
SCHEMBL12244147 0.80 MCHR1 (0.47) MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9580425-B2 Pyrido[3,4-b] indoles and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2017-02-28 US disclosed
US-9199996-B2 Pyrido[4,3-B]indoles and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2015-12-01 US disclosed
US-9045482-B2 Pyrido[4,3-B]indoles and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2015-06-02 US disclosed
US-20150005322-A1 PYRIDO[3,4-B] INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. 2015-01-01 US disclosed
US-8859561-B2 Pyrido[4,3-b]indoles and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2014-10-14 US disclosed
US-20130190344-A1 PYRIDO[4,3-B]INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2013-07-25 US disclosed
US-20130184304-A1 PYRIDO[4,3-B]INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2013-07-18 US disclosed
US-20130184303-A1 PYRIDO[4,3-B]INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2013-07-18 US disclosed
US-20110245272-A1 PYRIDO[4,3-B]INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. 2011-10-06 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 (5 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-20150005322-A1 PYRIDO[3,4-B] INDOLES AND METHODS OF USE HTR3B, HTR2C, HTR4 MCHR1 172/4885BAZ2B 1332/4885SIRT1 3184/4885
US-20130184304-A1 PYRIDO[4,3-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C MCHR1 171/4885BAZ2B 1353/4885SIRT1 3177/4885
US-20130190344-A1 PYRIDO[4,3-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C MCHR1 171/4885BAZ2B 1353/4885SIRT1 3177/4885
US-20110245272-A1 PYRIDO[4,3-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C MCHR1 171/4885BAZ2B 1353/4885SIRT1 3177/4885
US-20130184303-A1 PYRIDO[4,3-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C MCHR1 171/4885BAZ2B 1353/4885SIRT1 3177/4885

“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.