SCHEMBL1120400

SCHEMBL1120400

O=C1C=NC=C2N=c3ccccc3=C12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.38
ALDH1A1 P00352 4/20 0.38
MAPK10 P53779 3/20 0.38
PKM P14618 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KMT2A Q03164 6/20 0.35
MEN1 O00255 4/20 0.35
POLB P06746 3/20 0.35
LMNA P02545 2/20 0.35
TGM2 P21980 1/20 0.34
ATM Q13315 1/20 0.33
MAPK1 P28482 2/20 0.32
CGAS Q8N884 1/20 0.32
GAA P10253 1/20 0.32
USP2 O75604 1/20 0.32
BLM P54132 1/20 0.32
MCL1 Q07820 1/20 0.32
CCR6 P51684 1/20 0.32
NLRP3 Q96P20 1/20 0.31
ALK Q9UM73 1/20 0.31

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
SCHEMBL1173044 0.73
Water SCHEMBL4797117 0.72
SCHEMBL1649691 0.71 MAPT (0.38) MAPTALDH1A1MAPK10PKMNPSR1
SCHEMBL29161382 0.68 MAPT (0.54) MAPTALDH1A1MAPK10PKMNPSR1
SCHEMBL9666118 0.65 MAPT (0.38) MAPTALDH1A1MAPK10PKMNPSR1
SCHEMBL8890839 0.64 MAPT (0.35) MAPTALDH1A1MAPK10PKMNPSR1
SCHEMBL793243 0.64 MAPT (0.38) MAPTALDH1A1MAPK10PKMNPSR1
SCHEMBL3905504 0.63 MAPT (0.34) MAPTALDH1A1MAPK10PKMNPSR1
SCHEMBL4132834 0.63 MAPT (0.37) MAPTALDH1A1MAPK10PKMNPSR1
SCHEMBL16291698 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9469641-B2 Pyrido[3,4-B]indoles and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2016-10-18 US disclosed
US-9260429-B2 Pyrido[3,4-B]indoles and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2016-02-16 US disclosed
US-20130190323-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2013-07-25 US disclosed
US-20130184306-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2013-07-18 US disclosed
US-20130131077-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2013-05-23 US disclosed
US-20130079352-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2013-03-28 US disclosed
US-8338447-B2 Pyrido[3,4-B]indoles and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2012-12-25 US disclosed
EP-2280968-A2 PYRIDO [3, 4-B]INDOLES AND METHODS OF USE Medivation Technologies, Inc. (US) 2011-02-09 EP disclosed
US-20090270412-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. 2009-10-29 US disclosed
WO-2009120717-A2 PYRIDO [3, 4-B] INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2009-10-01 WO 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-20130184306-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C MAPT 214/4885ALDH1A1 1514/4885MAPK10 2114/4885
US-20130079352-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C MAPT 214/4885ALDH1A1 1514/4885MAPK10 2114/4885
US-20090270412-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C MAPT 214/4885ALDH1A1 1514/4885MAPK10 2114/4885
US-20130190323-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C MAPT 214/4885ALDH1A1 1514/4885MAPK10 2114/4885
US-20130131077-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE HTR3B, HTR2C, HTR4 MAPT 230/4885ALDH1A1 1607/4885MAPK10 1919/4885

“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.