SCHEMBL4882902

SCHEMBL4882902

Cc1ccccc1-n1nc2c(c1NC(=O)c1ccccc1C(F)(F)F)CSC2

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.64
THRB P10828 1/20 0.64
MEN1 O00255 6/20 0.62
KMT2A Q03164 6/20 0.62
HSD17B10 Q99714 6/20 0.62
POLB P06746 5/20 0.62
CYP3A4 P08684 3/20 0.59
CYP2C9 P11712 3/20 0.59
CYP2D6 P10635 1/20 0.59
NPSR1 Q6W5P4 3/20 0.56
USP2 O75604 2/20 0.56
RECQL P46063 2/20 0.56
CYP2C19 P33261 2/20 0.56
ALDH1A1 P00352 6/20 0.55
FPR1 P21462 1/20 0.55
TSHR P16473 4/20 0.53
KDM4E B2RXH2 3/20 0.52
HTT P42858 1/20 0.52
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51

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
SCHEMBL4881992 0.86 TSHR (0.69) MAPTMEN1KMT2AHSD17B10POLB
SCHEMBL4877396 0.84 HSD17B10 (0.62) MEN1KMT2AHSD17B10POLBCYP3A4
SCHEMBL4882943 0.82 ALDH1A1 (0.53) MEN1KMT2AHSD17B10CYP3A4CYP2C9
SCHEMBL833831 0.79 CYP3A4 (0.73) MAPTTHRBMEN1KMT2AHSD17B10
SCHEMBL5449752 0.78 MEN1 (0.61) MAPTTHRBMEN1KMT2AHSD17B10
SCHEMBL4882118 0.76 ENPP2 (0.57) MAPTTHRBMEN1KMT2AHSD17B10
SCHEMBL4881088 0.74 MAPT (0.73) MAPTTHRBMEN1KMT2AHSD17B10
SCHEMBL4881700 0.74 HTT (0.67) MEN1KMT2AHSD17B10POLBCYP3A4
SCHEMBL4878775 0.74 MAPT (0.76) MAPTTHRBMEN1KMT2AHSD17B10
SCHEMBL4941399 0.72 MAPT (0.64) MAPTTHRBMEN1KMT2AHSD17B10

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
US-20080249154-A1 Preventive and/or Therapeutic Agent For Disease In Which Mitochondrial Benzodiazephine Receptor Participates ONO PHARMACEUTICAL CO., LTD. (JP) 2008-10-09 US disclosed
EP-1698335-A1 PREVENTIVE AND/OR THERAPEUTIC AGENT FOR DISEASE IN WHICH MITOCHONDRIAL BENZODIAZEPINE RECEPTOR PARTICIPATES ONO PHARMACEUTICAL CO., LTD. (JP) 2006-09-06 EP 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-20080249154-A1 Preventive and/or Therapeutic Agent For Disease In Which Mitochondrial Benzodiazephine Receptor Participates MTNR1A, GSR, NLN MAPT 2701/4885THRB 566/4885MEN1 2666/4885

“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.