SCHEMBL360641

SCHEMBL360641

CCCCNC(=O)c1ccc(Br)cc1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.57
TSHR P16473 1/20 0.57
SMN1; SMN2 Q16637 4/20 0.50
HPGD P15428 4/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
ALDH1A1 P00352 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA3 P07451 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA5A P35218 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA13 Q8N1Q1 1/20 0.50
CA14 Q9ULX7 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
HDAC3 O15379 1/20 0.50

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
SCHEMBL2800276 0.84 SMN1; SMN2 (0.50) HTTSMN1; SMN2HPGDNPC1RAB9A
SCHEMBL4598743 0.84 SMN1; SMN2 (0.68) HTTTSHRSMN1; SMN2HPGDNPC1
SCHEMBL3658275 0.84 FLT1 (0.50) HTTTSHRSMN1; SMN2HPGDNPC1
SCHEMBL582402 0.84 TMEM97 (0.61) HTTTSHRSMN1; SMN2HPGDNPC1
SCHEMBL1420957 0.82 HTT (0.57) HTTTSHRSMN1; SMN2HPGDNPC1
SCHEMBL27452028 0.82 HTT (0.57) HTTTSHRSMN1; SMN2HPGDNPC1
SCHEMBL28022560 0.81 HTT (0.53) HTTTSHRSMN1; SMN2HPGDNPC1
SCHEMBL359164 0.79 HTT (0.54) HTTTSHRSMN1; SMN2HPGDNPC1
SCHEMBL4495229 0.79 TSHR (0.61) HTTTSHRSMN1; SMN2HPGDNPC1
SCHEMBL4768144 0.79 HDAC3 (0.71) HTTTSHRSMN1; SMN2HPGDNPC1

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-8980892-B2 Insecticidal compounds SYNGENTA CROP PROTECTION LLC (US) 2015-03-17 US disclosed
EP-2411384-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-01-30 EP disclosed
EP-2411384-A1 INSECTICIDAL COMPOUNDS Syngenta Participations AG (CH) 2012-02-01 EP disclosed
US-20120015946-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, LLC (US) 2012-01-19 US disclosed
WO-2010108733-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2010-09-30 WO 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-20120015946-A1 INSECTICIDAL COMPOUNDS ACHE, CHRM1, C1R HTT 3169/4885TSHR 1739/4885SMN1; SMN2 584/4885

“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.