SCHEMBL1120660

SCHEMBL1120660

CCOC(=O)CN(N)c1ccccn1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
KDM4E B2RXH2 5/20 0.43
HSD17B10 Q99714 3/20 0.43
CASP1 P29466 1/20 0.43
SMN1; SMN2 Q16637 4/20 0.42
GAA P10253 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 4/20 0.41
HPGD P15428 3/20 0.41
HTT P42858 2/20 0.41
NPC1 O15118 2/20 0.40
TP53 P04637 2/20 0.40
TRPM8 Q7Z2W7 2/20 0.40
RAB9A P51151 1/20 0.40
POLB P06746 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
SCHEMBL3254096 0.84 LMNA (0.51) LMNAKDM4EHSD17B10CASP1SMN1; SMN2
SCHEMBL915614 0.78 TSHR (0.46) LMNAKDM4EHSD17B10SMN1; SMN2MEN1
SCHEMBL8188478 0.78 SMN1; SMN2 (0.53) LMNAKDM4EHSD17B10SMN1; SMN2GAA
SCHEMBL4840210 0.77 POLB (0.46) LMNASMN1; SMN2GAAMEN1KMT2A
SCHEMBL2393888 0.77 SMN1; SMN2 (0.51) LMNAKDM4ESMN1; SMN2GAAMEN1
SCHEMBL9430458 0.76 SMN1; SMN2 (0.54) KDM4EHSD17B10SMN1; SMN2GAAMEN1
SCHEMBL12885929 0.75 KDM4E (0.51) LMNAKDM4ESMN1; SMN2ALDH1A1TRPM8
SCHEMBL15150399 0.75 LMNA (0.49) LMNAKDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL9069781 0.75 LMNA (0.48) LMNAKDM4EHSD17B10CASP1SMN1; SMN2
SCHEMBL13688238 0.74 TRPM8 (0.52) LMNAKDM4EHSD17B10SMN1; SMN2GAA

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-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
CN-102083830-B Pyrido [3,4-b ] indoles and methods of use MEDIVATION TECHNOLOGIES INC 2014-11-12 CN 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
CN-102083830-A Pyrido [3,4-b ] indoles and methods of use MEDIVATION TECHNOLOGIES INC 2011-06-01 CN 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 LMNA 4568/4885KDM4E 1637/4885HSD17B10 2868/4885
US-20130079352-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C LMNA 4568/4885KDM4E 1637/4885HSD17B10 2868/4885
US-20090270412-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C LMNA 4568/4885KDM4E 1637/4885HSD17B10 2868/4885
US-20130190323-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C LMNA 4568/4885KDM4E 1637/4885HSD17B10 2868/4885
US-20130131077-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE HTR3B, HTR2C, HTR4 LMNA 4622/4885KDM4E 1731/4885HSD17B10 2468/4885

“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.