SCHEMBL4876170

SCHEMBL4876170

O=C(N/N=C(\C=N\O)c1cccc(O)c1)c1cccc(Br)c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MTOR P42345 4/20 0.58
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C19 P33261 1/20 0.51
OGG1 O15527 2/20 0.51
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAPT P10636 5/20 0.48
KMT2A Q03164 2/20 0.48
CCR6 P51684 1/20 0.48
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 2/20 0.47
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
CTSL P07711 1/20 0.47
EGLN2 Q96KS0 1/20 0.47
AGTR1 P30556 1/20 0.46
OPRK1 P41145 1/20 0.46

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
SCHEMBL4876180 1.00 MTOR (0.58) MTORCYP1A2CYP3A4CYP2C19OGG1
SCHEMBL4878014 0.88 NPC1 (0.59) MTORCYP1A2CYP3A4CYP2C19OGG1
SCHEMBL4878016 0.88 NPC1 (0.59) MTORCYP1A2CYP3A4CYP2C19OGG1
SCHEMBL4888888 0.87 CYP1A2 (0.64) MTORCYP1A2CYP3A4CYP2C19OGG1
SCHEMBL4888895 0.87 CYP1A2 (0.64) MTORCYP1A2CYP3A4CYP2C19OGG1
SCHEMBL4878370 0.87 KMT2A (0.45) MTORNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4886123 0.87 KMT2A (0.48) MTORNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4886121 0.87 KMT2A (0.48) MTORNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4878364 0.87 KMT2A (0.45) MTORNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4903099 0.86 MAPT (0.50) MTORCYP1A2CYP3A4CYP2C19OGG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080227787-A1 Use of New Lipoxygenase Inhibitors BIOLIPOX AB (SE) 2008-09-18 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-20080227787-A1 Use of New Lipoxygenase Inhibitors ALOX15, ALOX15B, ALOX12 MTOR 3042/4885CYP1A2 74/4885CYP3A4 260/4885

“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.