SCHEMBL1508787

SCHEMBL1508787

C[C@@]1(c2ccc(Cl)cc2)NC(=S)N[C@@H]1c1ccc(Cl)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.36
ALDH1A1 P00352 1/20 0.34
PGR P06401 2/20 0.32
LMNA P02545 1/20 0.32
P2RX7 Q99572 2/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
SLC6A2 P23975 3/20 0.31
SLC6A4 P31645 3/20 0.31
SLC6A3 Q01959 3/20 0.31
GUSB P08236 1/20 0.31
ESR1 P03372 1/20 0.31
NR3C1 P04150 1/20 0.31
NR3C2 P08235 1/20 0.31
AR P10275 1/20 0.31
ESR2 Q92731 1/20 0.31
CHRNA1 P02708 1/20 0.31
CHRNG P07510 1/20 0.31

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
SCHEMBL13567931 1.00 NPSR1 (0.36) NPSR1ALDH1A1PGRLMNAP2RX7
SCHEMBL13567917 0.93 ALDH1A1 (0.34) NPSR1ALDH1A1LMNAP2RX7MEN1
SCHEMBL1508821 0.88 HDAC11 (0.33) ALDH1A1MEN1KMT2A
SCHEMBL4204488 0.85 NPSR1 (0.42) NPSR1ALDH1A1LMNAMEN1GAA
SCHEMBL1508961 0.85 NPSR1 (0.42) NPSR1ALDH1A1LMNAMEN1GAA
SCHEMBL3873239 0.85 NPSR1 (0.42) NPSR1ALDH1A1LMNAMEN1GAA
SCHEMBL3834348 0.85 NPSR1 (0.42) NPSR1ALDH1A1LMNAMEN1GAA
SCHEMBL3834344 0.85 NPSR1 (0.42) NPSR1ALDH1A1LMNAMEN1GAA
SCHEMBL1508909 0.85 KCNQ3 (0.37) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL13567908 0.85 ALDH1A1 (0.35) NPSR1ALDH1A1PGRLMNAP2RX7

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
US-20130172362-A1 Imidazothiazole Derivatives Having Proline Ring Structure DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-07-04 US disclosed
US-20130172362-A1 Imidazothiazole Derivatives Having Proline Ring Structure DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-07-04 US disclosed
US-8404691-B2 Imidazothiazole derivatives having proline ring structure DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-03-26 US disclosed
US-8404691-B2 Imidazothiazole derivatives having proline ring structure DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-03-26 US disclosed
EP-2380892-A1 IMIDAZOTHIAZOLE DERIVATIVE HAVING PROLINE RING STRUCTURE Daiichi Sankyo Company, Limited (JP) 2011-10-26 EP disclosed
EP-2298778-A1 IMIDAZOTHIAZOLE DERIVATIVE HAVING 4,7-DIAZASPIROÝ2.5¨OCTANE RING STRUCTURE Daiichi Sankyo Company, Limited (JP) 2011-03-23 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-20130172362-A1 Imidazothiazole Derivatives Having Proline Ring Structure MDM2, TP53, TP53BP1 NPSR1 3866/4885ALDH1A1 2814/4885PGR 2739/4885

“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.