SCHEMBL9995199

SCHEMBL9995199

Cc1cccc2nc(N)n(-c3ccc(Br)cc3)c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 5/20 0.46
TLR8 Q9NR97 1/20 0.46
PRMT5 O14744 1/20 0.40
TSHR P16473 1/20 0.38
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
CASP3 P42574 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
GRM1 Q13255 1/20 0.35
PLAUR Q03405 1/20 0.35
KMT2A Q03164 2/20 0.35
TLR7 Q9NYK1 1/20 0.34
MEN1 O00255 1/20 0.34
HCRTR1 O43613 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL9995172 0.82 PRMT5 (0.54) HCAR1PRMT5NPC1RAB9AGAA
SCHEMBL9995179 0.74 NPC1 (0.52) HCAR1TLR8NPC1RAB9AGAA
SCHEMBL5457312 0.72 PRMT5 (0.66) TLR8PRMT5NPC1RAB9AGAA
SCHEMBL9995244 0.70 HCAR1 (0.46) HCAR1TLR8TSHRNPC1RAB9A
SCHEMBL9994923 0.70 TP53 (0.40) NPC1RAB9AGAAMAPTSMN1; SMN2
SCHEMBL9995140 0.70 TLR8 (0.46) HCAR1TLR8PRMT5NPC1RAB9A
SCHEMBL540941 0.69 MAPK1 (0.61) HCAR1TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL1104846 0.67 ESR1 (0.49) HCAR1NPC1RAB9AGAAMAPT
SCHEMBL14247504 0.67 HCAR1 (0.49) HCAR1TLR8TSHRNPC1RAB9A
SCHEMBL27652457 0.66 PIK3CD (0.46) HCAR1NPC1MAPTSMN1; SMN2GRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2582680-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES Novartis AG (CH) 2013-04-24 EP disclosed
US-20130090342-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2013-04-11 US disclosed
US-20130090342-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2013-04-11 US disclosed
US-20130090342-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2013-04-11 US disclosed
WO-2011157787-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2011-12-22 WO disclosed
WO-2011157787-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2011-12-22 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-20130090342-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES IGF1R, IGFBP1, IGFBP2 HCAR1 406/4885TLR8 865/4885PRMT5 803/4885

“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.