SCHEMBL423103

SCHEMBL423103

Cc1cc(C(=O)N2CCC2)cnc1Cl

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.48
KMT2A Q03164 4/20 0.47
MEN1 O00255 2/20 0.47
HPGD P15428 8/20 0.46
RAB9A P51151 1/20 0.44
CNR1 P21554 1/20 0.43
TSHR P16473 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD11B1 P28845 1/20 0.43
PDK2 Q15119 1/20 0.42

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
SCHEMBL6824364 0.97 GRM5 (0.51) GRM5KMT2AMEN1HPGDCNR1
SCHEMBL423467 0.84 KMT2A (0.59) GRM5KMT2AMEN1HPGDCNR1
SCHEMBL1427046 0.81 MEN1 (0.59) GRM5KMT2AMEN1HPGDCNR1
SCHEMBL23675259 0.77 HPGD (0.52) GRM5HPGDCNR1TSHRALDH1A1
SCHEMBL29994736 0.77 HPGD (0.52) GRM5HPGDCNR1TSHRALDH1A1
SCHEMBL6821163 0.77 HPGD (0.49) GRM5KMT2AHPGDCNR1TSHR
SCHEMBL990157 0.77 GRM5 (0.64) GRM5KMT2AMEN1HPGDALDH1A1
SCHEMBL15500046 0.74 KCNQ3 (0.40) KMT2AMEN1RAB9AALDH1A1SMN1; SMN2
SCHEMBL427869 0.74 HCAR2 (0.47) KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL13859498 0.74 KMT2A (0.40) KMT2AMEN1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2239253-B1 NOVEL PHENYLPYRROLE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2013-06-19 EP disclosed
US-8415359-B2 Phenylpyrrole derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-04-09 US disclosed
US-20120022075-A1 NOVEL PHENYLPYRROLE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-01-26 US disclosed
US-8017610-B2 Phenylpyrrole derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-09-13 US disclosed
US-20110003787-A1 NOVEL PHENYLPYRROLE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-01-06 US disclosed
EP-2239253-A1 NOVEL PHENYLPYRROLE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2010-10-13 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 (2 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-20110003787-A1 NOVEL PHENYLPYRROLE DERIVATIVE GCKR, GCK, SLC5A1 GRM5 245/4885KMT2A 2958/4885MEN1 3897/4885
US-20120022075-A1 NOVEL PHENYLPYRROLE DERIVATIVE GCKR, GCK, SLC5A1 GRM5 245/4885KMT2A 2958/4885MEN1 3897/4885

“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.