SCHEMBL16256155

SCHEMBL16256155

CN(C)c1cnc(NCCc2ccc(Cl)cc2)[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTBK1 Q5TCY1 1/20 0.44
TTBK2 Q6IQ55 1/20 0.44
HTT P42858 3/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 2/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TAAR1 Q96RJ0 2/20 0.42
GPR84 Q9NQS5 1/20 0.42
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
MAPK1 P28482 1/20 0.40
GALR3 O60755 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 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
SCHEMBL14869385 0.76 POLB (0.44) TTBK1TTBK2HTTL3MBTL1MEN1
SCHEMBL10504189 0.69 HDAC3 (0.41) L3MBTL1MEN1KMT2ALMNAHDAC3
SCHEMBL14869383 0.68 GPR84 (0.46) TTBK1TTBK2HTTL3MBTL1MEN1
SCHEMBL14869393 0.68 POLB (0.44) TTBK1TTBK2HTTL3MBTL1MEN1
SCHEMBL26268886 0.67 CNR1 (0.63) TSHRTAAR1GPR84MAPK1ALDH1A1
SCHEMBL10503035 0.67 HDAC3 (0.40) L3MBTL1MEN1KMT2ALMNAHDAC3
SCHEMBL18448724 0.66 KDM4E (0.71) TTBK1TTBK2HTTMEN1KMT2A
SCHEMBL14870277 0.64 TAAR1 (0.40) TTBK1TTBK2HTTL3MBTL1MEN1
SCHEMBL14869765 0.63 CA1 (0.57)
SCHEMBL8520558 0.63 GPR84 (0.46) TTBK1TTBK2HTTL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140341986-A1 Biguanide Compositions and Methods of Treating Metabolic Disorders ANJI PHARMACEUTICALS INC. 2014-11-20 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-20140341986-A1 Biguanide Compositions and Methods of Treating Metabolic Disorders SLC5A2, SLC5A1, GPR119 TTBK1 4010/4885TTBK2 3435/4885HTT 637/4885

“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.