SCHEMBL3576186

SCHEMBL3576186

CNc1ccccc1C(=O)NCCc1ccc(F)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.57
RAB9A P51151 6/20 0.57
SMN1; SMN2 Q16637 4/20 0.56
ALDH1A1 P00352 3/20 0.56
MT-CO2 P00403 1/20 0.55
SLC6A5 Q9Y345 1/20 0.52
POLB P06746 1/20 0.52
KDM4E B2RXH2 1/20 0.51
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
PARP1 P09874 1/20 0.50
PLAAT3 P53816 1/20 0.50
PLAAT5 Q96KN8 1/20 0.50
PLAAT2 Q9NWW9 1/20 0.50
PLAAT4 Q9UL19 1/20 0.50
HPGD P15428 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
SCHEMBL3407189 0.88 RAB9A (0.63) NPC1RAB9ASMN1; SMN2ALDH1A1MT-CO2
SCHEMBL29858570 0.88 RAB9A (0.63) NPC1RAB9ASMN1; SMN2ALDH1A1MT-CO2
SCHEMBL3577771 0.86 NPC1 (0.55) NPC1RAB9ASMN1; SMN2ALDH1A1MT-CO2
SCHEMBL14606883 0.83 GAA (0.48) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL2577570 0.77 L3MBTL1 (0.64) SMN1; SMN2ALDH1A1POLBKDM4ELMNA
SCHEMBL10748316 0.77 CRBN (0.56) SMN1; SMN2ALDH1A1POLBKDM4ELMNA
SCHEMBL2332195 0.76 RAB9A (0.88) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL5055189 0.76 CRBN (0.54) SMN1; SMN2ALDH1A1POLBKDM4EHPGD
SCHEMBL29922998 0.76 CRBN (0.54) SMN1; SMN2ALDH1A1POLBKDM4EHPGD
SCHEMBL1585240 0.76 SMN1; SMN2 (0.53) NPC1RAB9ASMN1; SMN2ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7678818-B2 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. (US) 2010-03-16 US disclosed
US-20070219261-A1 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. 2007-09-20 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-20070219261-A1 Anthranilamide and 2-amino-heteroarene-carboxamide compounds AADAT, AAAS, AADAC NPC1 3237/4885RAB9A 1226/4885SMN1; SMN2 2333/4885

“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.