SCHEMBL9907362

SCHEMBL9907362

O=C(O)c1ccc2nccc(-c3cc(Cl)ccc3Cl)c2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 1/20 0.49
CSNK2A2 P19784 1/20 0.43
CSNK2B P67870 1/20 0.43
TSHR P16473 2/20 0.42
TTR P02766 2/20 0.42
CDH1 P12830 1/20 0.42
APC P25054 1/20 0.42
CTNNB1 P35222 1/20 0.42
TCF7L2 Q9NQB0 1/20 0.42
KMO O15229 1/20 0.42
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
SRD5A2 P31213 2/20 0.41
SRD5A1 P18405 1/20 0.41
NR4A2 P43354 1/20 0.41
NPC1 O15118 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL9907342 0.89 SRD5A2 (0.49) MAPKAPK2CSNK2A2CSNK2BTTRCDH1
SCHEMBL9907372 0.88 MAPKAPK2 (0.48) MAPKAPK2CSNK2A2CSNK2BTTRCDH1
SCHEMBL9907478 0.87 HTR5A (0.41) MAPKAPK2TSHRKMOALDH1A1NR4A2
SCHEMBL9907358 0.85 HTT (0.47) MAPKAPK2CSNK2A2CSNK2BALDH1A1TP53
SCHEMBL9907352 0.84 KMO (0.51) MAPKAPK2CSNK2A2CSNK2BTTRCDH1
SCHEMBL9907387 0.83 MAPKAPK2 (0.45) MAPKAPK2CSNK2A2CSNK2BTSHRTTR
SCHEMBL9907800 0.83 HTR5A (0.50)
SCHEMBL9907343 0.80 DOT1L (0.42) MAPKAPK2CSNK2A2CSNK2BTSHRTTR
SCHEMBL9907363 0.80 DOT1L (0.44) MAPKAPK2CSNK2A2CSNK2BTSHRTTR
SCHEMBL7689552 0.79 TSHR (0.48) MAPKAPK2CSNK2A2CSNK2BTSHRCDH1

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-8853242-B2 Nitrogenous-ring acylguanidine derivative ASTELLAS PHARMA INC. (JP) 2014-10-07 US disclosed
US-8853242-B2 Nitrogenous-ring acylguanidine derivative ASTELLAS PHARMA INC. (JP) 2014-10-07 US disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 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-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE HTR5A, HTR2A, HTR1E MAPKAPK2 4333/4885CSNK2A2 4132/4885CSNK2B 4303/4885

“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.