SCHEMBL4255650

SCHEMBL4255650

Cc1nc(N[C@H]2CC[C@@H](C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc(N(C)C)n1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
NR1I2 O75469 1/20 0.50
AHR P35869 1/20 0.50
MALT1 Q9UDY8 8/20 0.48
MEN1 O00255 3/20 0.47
ALDH1A1 P00352 3/20 0.47
GAA P10253 1/20 0.47
KCNH2 Q12809 1/20 0.44
HTT P42858 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
TSHR P16473 1/20 0.41

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
SCHEMBL4255651 1.00 KMT2A (0.50) KMT2ANR1I2AHRMALT1MEN1
Hydrochloric Acid SCHEMBL4256048 0.99 KMT2A (0.49) KMT2ANR1I2AHRMALT1MEN1
Hydrochloric Acid SCHEMBL4256042 0.99 KMT2A (0.49) KMT2ANR1I2AHRMALT1MEN1
SCHEMBL4264158 0.91 MCHR1 (0.47) KMT2ANR1I2AHRSMN1; SMN2
SCHEMBL4264164 0.91 MCHR1 (0.47) KMT2ANR1I2AHRSMN1; SMN2
Hydrochloric Acid SCHEMBL4256601 0.90 MCHR1 (0.46) SMN1; SMN2
Hydrochloric Acid SCHEMBL4256596 0.90 MCHR1 (0.46) SMN1; SMN2
SCHEMBL4256525 0.85 MCHR1 (0.39) LMNA
Hydrochloric Acid SCHEMBL4263713 0.85 MEN1 (0.47) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL4256520 0.85 MCHR1 (0.39) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090036448-A1 PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMECUTICAL CO., LTD. (JP) 2009-02-05 US claimed
EP-1730122-A2 PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMACEUTICAL CO., LTD (JP) 2006-12-13 EP claimed
WO-2005095357-A2 PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMACEUTICAL CO., LTD. (JP) 2005-10-13 WO claimed
US-20090036448-A1 PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMECUTICAL CO., LTD. (JP) 2009-02-05 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-20090036448-A1 PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF GPR119, HCRTR2, MCHR1 KMT2A 857/4885NR1I2 938/4885AHR 512/4885

“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.