SCHEMBL280045

SCHEMBL280045

Cc1ccc(C(=O)CSCc2cccnc2)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.47
CHRNA7 P36544 1/20 0.47
CHRNA4 P43681 1/20 0.47
ADORA2A P29274 3/20 0.44
ADORA2B P29275 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
RAB9A P51151 3/20 0.44
ALDH1A1 P00352 3/20 0.43
LMNA P02545 2/20 0.43
CCNE2 O96020 1/20 0.43
CCNE1 P24864 1/20 0.43
CDK2 P24941 1/20 0.43
CYP3A4 P08684 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
NAPRT Q6XQN6 1/20 0.40
NAMPT P43490 1/20 0.40
TSHR P16473 1/20 0.39

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
SCHEMBL280130 0.85 NPC1 (0.44) L3MBTL1RAB9AALDH1A1LMNACYP3A4
SCHEMBL7405579 0.70 CYP1A2 (0.56) CHRNB2CHRNA7CHRNA4L3MBTL1ALDH1A1
SCHEMBL13060968 0.70 RAB9A (0.50) L3MBTL1RAB9AALDH1A1LMNAHTT
SCHEMBL11192784 0.68 CYP2C19 (0.47) CCNE2CCNE1CDK2CYP3A4CYP2C9
SCHEMBL12854012 0.67 CHRNB2 (0.52) CHRNB2CHRNA7CHRNA4L3MBTL1ALDH1A1
SCHEMBL1770095 0.67 HSD11B1 (0.62) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL9388351 0.67 CYP3A4 (0.55) CHRNB2CHRNA7CHRNA4CCNE2CCNE1
SCHEMBL14625554 0.66 L3MBTL1 (0.64) L3MBTL1RAB9ALMNANAMPTHTT
SCHEMBL279739 0.66 ALDH1A1 (0.47) ADORA2AADORA2BL3MBTL1RAB9AALDH1A1
SCHEMBL27050646 0.65 ALDH1A1 (0.66) CHRNB2CHRNA4ALDH1A1LMNACYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8134013-B2 Amide compound and thrombopoietin receptor activator NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-03-13 US disclosed
US-8134013-B2 Amide compound and thrombopoietin receptor activator NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-03-13 US disclosed
US-20090131659-A1 AMIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-05-21 US disclosed
US-20090131659-A1 AMIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-05-21 US disclosed
EP-1845090-A1 AMIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR Nissan Chemical Industries, Ltd. (JP) 2007-10-17 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-20090131659-A1 AMIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR TEK, PTAFR, MPL CHRNB2 4318/4885CHRNA7 3753/4885CHRNA4 4028/4885

“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.