SCHEMBL2638178

SCHEMBL2638178

CC(=NN)c1csc(-c2ccc(C(F)(F)F)cc2)c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 13/20 0.38
HTR3E A5X5Y0 1/20 0.35
HTR3B O95264 1/20 0.35
PLAU P00749 1/20 0.35
HTR3A P46098 1/20 0.35
HTR3D Q70Z44 1/20 0.35
HTR3C Q8WXA8 1/20 0.35
NOS1 P29475 4/20 0.33
NOS3 P29474 3/20 0.33
LTA4H P09960 1/20 0.33
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
NOS2 P35228 2/20 0.32
BLM P54132 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL14395479 1.00 KIF11 (0.38) KIF11HTR3EHTR3BPLAUHTR3A
SCHEMBL12755580 0.87 SLC22A2 (0.36) KIF11ALDH1A1LMNA
SCHEMBL3986371 0.87 SLC22A2 (0.36) KIF11ALDH1A1LMNA
SCHEMBL12755581 0.83 AKR1C2 (0.36) KIF11NOS1NOS3NOS2
SCHEMBL14395494 0.82 RAB9A (0.36) HTR3EHTR3BPLAUHTR3AHTR3D
SCHEMBL12755575 0.81 EGFR (0.34) ALDH1A1LMNATP53
SCHEMBL14625178 0.81 KIF11 (0.41) KIF11LTA4HALDH1A1
SCHEMBL14395814 0.81
SCHEMBL2638191 0.81 NOS1 (0.36) PLAUNOS1ALDH1A1
SCHEMBL278003 0.81 KIF11 (0.41) KIF11ALDH1A1LMNACYP1A2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968542-B2 Thiophene compounds and thrombopoietin receptor activators NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-06-28 US claimed
US-7968542-B2 Thiophene compounds and thrombopoietin receptor activators NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-06-28 US disclosed
US-20090118500-A1 THIOPHENE COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES, LTD (JP) 2009-05-07 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-20090118500-A1 THIOPHENE COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS TEK, MPL, THPO KIF11 3700/4885HTR3E 591/4885HTR3B 944/4885

“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.