SCHEMBL5236012

SCHEMBL5236012

Cn1c(CNC(=O)O)c(OCc2cccc3ccccc23)c2cc(Cl)ccc2c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.41
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HPGD P15428 1/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
CCR4 P51679 4/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 2/20 0.40
MAPT P10636 2/20 0.40
CYP2C19 P33261 2/20 0.40
POLB P06746 1/20 0.40
ALPG P10696 1/20 0.40
CYP2C9 P11712 1/20 0.40
HTT P42858 1/20 0.40
ACKR3 P25106 1/20 0.39
FDPS P14324 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38

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
SCHEMBL5237954 0.86 MEN1 (0.43) DPP4LMNASMN1; SMN2MEN1KMT2A
SCHEMBL5236656 0.85 DPP4 (0.44) DPP4LMNAMEN1KMT2ACYP1A2
SCHEMBL7003591 0.84 DPP4 (0.54) DPP4LMNAMEN1KMT2ACYP1A2
SCHEMBL5240287 0.84 MEN1 (0.43) DPP4LMNAMEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL5234930 0.84 DPP4 (0.53) DPP4LMNAMEN1KMT2ACYP1A2
SCHEMBL6106926 0.82 DPP4 (0.39) DPP4LMNAMEN1KMT2ACCR4
SCHEMBL6695926 0.81 DPP4 (0.45) DPP4CYP3A4MAPTHTTTHRB
SCHEMBL6106923 0.80 MEN1 (0.38) DPP4LMNASMN1; SMN2HPGDMEN1
SCHEMBL5236940 0.80 MAPT (0.40) LMNASMN1; SMN2HPGDMEN1KMT2A
SCHEMBL5236019 0.80 MEN1 (0.40) DPP4LMNASMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1355886-B1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL (JP) 2007-07-11 EP disclosed
US-20040082607-A1 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-29 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-20040082607-A1 Fused heterocyclic compounds DPP7, DPP4, METAP1 DPP4 2/4885LMNA 1764/4885SMN1; SMN2 4002/4885

“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.