SCHEMBL10180209

SCHEMBL10180209

CS(=O)(=O)c1ccc2c(ccn2Cc2ccc(C3CCNCC3)cn2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 2/20 0.41
CDK6 Q00534 2/20 0.41
KDM1A O60341 1/20 0.37
JAK3 P52333 4/20 0.36
PTK2 Q05397 1/20 0.36
JAK2 O60674 5/20 0.36
BRD4 O60885 3/20 0.36
JAK1 P23458 3/20 0.36
BRD2 P25440 1/20 0.36
BRD3 Q15059 1/20 0.36
BRDT Q58F21 1/20 0.36
PLAT P00750 1/20 0.36
FAAH O00519 1/20 0.35
IKBKB O14920 2/20 0.33
ROCK2 O75116 2/20 0.33
TYK2 P29597 2/20 0.33
ROCK1 Q13464 2/20 0.33
HTR6 P50406 2/20 0.33
CNR2 P34972 2/20 0.33
DUT P33316 1/20 0.33

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
SCHEMBL10180327 0.85 DRD2 (0.34) KDM1AGPR119DRD2
SCHEMBL10179883 0.85 DRD2 (0.36) GPR119DRD2
SCHEMBL10179523 0.82 PRMT5 (0.33) PTK2JAK2DRD2
SCHEMBL10179519 0.82 ATM (0.34) JAK3PTK2JAK2BRD4GPR119
SCHEMBL10181179 0.82 GPR119 (0.49) GPR119
SCHEMBL12544467 0.82 HRH3 (0.37)
SCHEMBL10180230 0.81 GPR119 (0.49) JAK3PTK2JAK2GPR119DDB1
SCHEMBL12544847 0.81 ATM (0.33)
Tert-Butyl Formate SCHEMBL28804582 0.79 KDM1A (0.33) CDK4CDK6KDM1AJAK3JAK2
SCHEMBL10179647 0.79 GPR119 (0.37) GPR119

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-20120245344-A1 GPR119 AGONIST NIPPON CHEMIPHAR CO., LTD. (JP) 2012-09-27 US disclosed
EP-2474540-A1 GPR119 AGONIST Nippon Chemiphar Co., Ltd. (JP) 2012-07-11 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-20120245344-A1 GPR119 AGONIST GPR119, GPR4, GPR55 CDK4 1852/4885CDK6 3289/4885KDM1A 2147/4885

“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.