SCHEMBL279838

SCHEMBL279838

Cc1ccc(C(=O)NCC2CCCN2)s1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ NPC1 O15118 3/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ CACNA1H O95180 1/20 0.47
▸ IKBKB O14920 6/20 0.44
▸ F10 P00742 2/20 0.44
▸ DRD2 P14416 2/20 0.44
▸ DRD3 P35462 2/20 0.44
▸ USP2 O75604 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CHUK O15111 1/20 0.43
▸ TAS1R3 Q7RTX0 1/20 0.43
▸ TAS1R1 Q7RTX1 1/20 0.43

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
SCHEMBL8251860 0.85 F10 (0.46) KMT2ARAB9ASMN1; SMN2IKBKBF10
SCHEMBL279926 0.78 SCN9A (0.54) NPC1RAB9ASMN1; SMN2IKBKBCHUK
SCHEMBL279976 0.75 KMT2A (0.67) POLBKMT2ATDP1NPC1RAB9A
SCHEMBL13266061 0.74 KMT2A (0.56) POLBKMT2ATDP1NPC1RAB9A
SCHEMBL31188482 0.74 ADRB1 (0.60) IKBKBCHUK
SCHEMBL8274391 0.74 ADRB1 (0.60) IKBKBCHUK
SCHEMBL5088410 0.74 ADRB1 (0.60) IKBKBCHUK
SCHEMBL17888386 0.74 SCN9A (0.58) NPC1RAB9ASMN1; SMN2IKBKB
SCHEMBL279575 0.74 HPGD (0.59) NPC1RAB9ADRD2
SCHEMBL17886781 0.73 SCN9A (0.57) NPC1RAB9ASMN1; SMN2ALDH1A1IKBKB

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-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
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 POLB 4352/4885KMT2A 3398/4885TDP1 2969/4885

“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.

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