SCHEMBL1481849

SCHEMBL1481849

CCn1cc(-c2ccccc2Cl)nc1/C=C/c1ccc(Br)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.43
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
MAPT P10636 5/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
TP53 P04637 4/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 3/20 0.34
HPGD P15428 2/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
PKM P14618 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
RXFP1 Q9HBX9 2/20 0.34
F2RL3 Q96RI0 1/20 0.34
PTGES O14684 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33

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
SCHEMBL1481852 1.00 TLR8 (0.43) TLR8RAB9ANPC1MAPTSMN1; SMN2
SCHEMBL1480339 0.86 LMNA (0.40) MAPTKDM4ETDP1
SCHEMBL1480335 0.86 LMNA (0.40) MAPTKDM4ETDP1
SCHEMBL1481119 0.85 KMT2A (0.42) TLR8RAB9ANPC1MAPTSMN1; SMN2
SCHEMBL1481116 0.85 KMT2A (0.42) TLR8RAB9ANPC1MAPTSMN1; SMN2
SCHEMBL1482180 0.84 TLR8 (0.45) TLR8RAB9ANPC1MAPTSMN1; SMN2
SCHEMBL1482178 0.84 TLR8 (0.45) TLR8RAB9ANPC1MAPTSMN1; SMN2
SCHEMBL6452095 0.82 BRS3 (0.41) TLR8RAB9ANPC1MAPTSMN1; SMN2
SCHEMBL1480504 0.81 ALDH1A1 (0.44) TLR8RAB9ANPC1MAPTALDH1A1
SCHEMBL1481442 0.81 NPC1 (0.43) TLR8RAB9ANPC1MAPTSMN1; SMN2

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-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents TRANSTECH PHARMA, INC. (US) 2011-03-31 US disclosed
US-20040192743-A1 Substituted azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. 2004-09-30 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 (2 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-20040192743-A1 Substituted azole derivatives as therapeutic agents PTPRS, PTPRO, PTPRJ TLR8 2695/4885RAB9A 3266/4885NPC1 3792/4885
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents PTPRS, PTPRO, PTPRJ TLR8 2695/4885RAB9A 3266/4885NPC1 3792/4885

“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.