SCHEMBL3305183

SCHEMBL3305183

O=C(NCCc1cccc(Cl)c1)N(S)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.49
TRPV1 Q8NER1 1/20 0.48
ALDH1A1 P00352 6/20 0.48
SMN1; SMN2 Q16637 5/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
HPGD P15428 1/20 0.48
TAAR1 Q96RJ0 2/20 0.46
PLAAT3 P53816 2/20 0.46
PLAAT5 Q96KN8 2/20 0.46
PLAAT2 Q9NWW9 2/20 0.46
PLAAT4 Q9UL19 2/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
HTT P42858 1/20 0.45
GAA P10253 1/20 0.43
THRB P10828 1/20 0.42
GLA P06280 1/20 0.42
TACR1 P25103 1/20 0.42

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
SCHEMBL4056627 0.88 MEN1 (0.49) KMT2AMEN1HPGDHTTGAA
SCHEMBL3297438 0.87 CNR1 (0.53) CNR1SMN1; SMN2TAAR1NPC1RAB9A
SCHEMBL3300429 0.87 TACR1 (0.52) PLAAT3PLAAT5PLAAT2PLAAT4NPC1
SCHEMBL4058379 0.82 TRPV1 (0.48) CNR1TRPV1ALDH1A1KMT2AMEN1
SCHEMBL7673079 0.80 ALDH1A1 (0.51) CNR1ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL6816639 0.78 KMT2A (0.49) CNR1TRPV1ALDH1A1SMN1; SMN2KMT2A
SCHEMBL3302246 0.78 CA12 (0.52) ALDH1A1SMN1; SMN2KMT2AMEN1HTT
SCHEMBL3300941 0.77 P2RX1 (0.48) ALDH1A1SMN1; SMN2KMT2AMEN1HPGD
SCHEMBL7594084 0.76 MAOB (0.51) CNR1TRPV1KMT2AMEN1TAAR1
SCHEMBL4064957 0.74 LMNA (0.53) ALDH1A1

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-20100093864-A1 ANTI-INFECTIVE THIOUREA COMPOUNDS LICA PHARMACEUTICALS (DK) 2010-04-15 US disclosed
EP-2074085-A2 ANTI-INFECTIVE THIOUREA COMPOUNDS Lica Pharmaceuticals A/S (DK) 2009-07-01 EP disclosed
WO-2008043840-A2 ANTI-INFECTIVE THIOUREA COMPOUNDS LICA PHARMACEUTICALS (DK) 2008-04-17 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-20100093864-A1 ANTI-INFECTIVE THIOUREA COMPOUNDS TST, TPX2, TPMT CNR1 1074/4885TRPV1 3120/4885ALDH1A1 4109/4885

“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.