SCHEMBL1090140

SCHEMBL1090140

C[C@@H]1CN(c2nnc(Cl)c3ccccc23)[C@@H](C)CN1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
GFER P55789 1/20 0.46
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.38
TSHR P16473 1/20 0.38
SMO Q99835 6/20 0.36
SIGMAR1 Q99720 2/20 0.36
HDAC1 Q13547 1/20 0.36
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
HTR2B P41595 2/20 0.36
PIM1 P11309 1/20 0.35
PRKCI P41743 1/20 0.35

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
SCHEMBL1090144 1.00 MEN1 (0.46) MEN1KMT2AGFERALDH1A1POLB
SCHEMBL14000711 1.00 MEN1 (0.46) MEN1KMT2AGFERALDH1A1POLB
SCHEMBL1106839 1.00 MEN1 (0.46) MEN1KMT2AGFERALDH1A1POLB
SCHEMBL1102307 1.00 MEN1 (0.46) MEN1KMT2AGFERALDH1A1POLB
SCHEMBL1102302 1.00 MEN1 (0.46) MEN1KMT2AGFERALDH1A1POLB
SCHEMBL1090146 1.00 MEN1 (0.46) MEN1KMT2AGFERALDH1A1POLB
SCHEMBL4149590 0.85 PRKCI (0.39) MEN1KMT2AGFERSMOHDAC1
SCHEMBL3691847 0.85 PRKCI (0.39) MEN1KMT2AGFERSMOHDAC1
SCHEMBL4149597 0.85 PRKCI (0.39) MEN1KMT2AGFERSMOHDAC1
SCHEMBL1091877 0.78 MEN1 (0.49) MEN1KMT2AGFERALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2170866-B1 PHTHALAZINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE AMGEN INC (US) 2014-08-13 EP disclosed
US-8153633-B2 Phthalazine compounds, compositions and methods of use AMGEN INC. (US) 2012-04-10 US disclosed
EP-2170866-A1 PHTHALAZINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE Amgen Inc. (US) 2010-04-07 EP disclosed
US-20090048259-A1 Phthalazine compounds, compositions and methods of use AMGEN INC. (US) 2009-02-19 US disclosed
WO-2009002469-A1 PHTHALAZINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE AMGEN INC. (US) 2008-12-31 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 (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-20090048259-A1 Phthalazine compounds, compositions and methods of use VHL, HDAC5, SUZ12 MEN1 471/4885KMT2A 670/4885GFER 3186/4885

“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.