SCHEMBL23609604

SCHEMBL23609604

O=[N+]([O-])c1ccc(NC(c2ccccc2)C(F)(F)F)nc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.55
KMT2A Q03164 7/20 0.55
MAPT P10636 6/20 0.55
LMNA P02545 1/20 0.55
ALDH1A1 P00352 4/20 0.53
HPGD P15428 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.51
POLB P06746 1/20 0.51
NPC1 O15118 2/20 0.51
ALOX12 P18054 1/20 0.46
RAB9A P51151 3/20 0.45
GAA P10253 2/20 0.45
CYP1A2 P05177 1/20 0.45
PKM P14618 1/20 0.44
HTT P42858 1/20 0.43
CCR6 P51684 1/20 0.42
AGTR1 P30556 1/20 0.41

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
SCHEMBL15022761 0.80 ALDH1A1 (0.74) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL2733724 0.80 ALDH1A1 (0.74) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL2792928 0.80 ALDH1A1 (0.74) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL31629180 0.80 ALDH1A1 (0.74) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6421334 0.76 NPC1 (0.57) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL30716729 0.72 ALDH1A1 (0.60) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL3018141 0.72 ALDH1A1 (0.60) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL17198268 0.72 MEN1 (0.55) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL3156844 0.72 MEN1 (0.69) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL913813 0.71 MEN1 (1.00) MEN1KMT2AMAPTLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230117592-A1 LIPOXYGENASE INHIBITORS SRI INTERNATIONAL (US) 2023-04-20 US disclosed
EP-4081199-A2 LIPOXYGENASE INHIBITORS SRI International (US) 2022-11-02 EP disclosed
CN-115135316-A Lipoxygenase inhibitors 思研(SRI)国际顾问与咨询公司 2022-09-30 CN disclosed
WO-2021133689-A2 LIPOXYGENASE INHIBITORS SRI INTERNATIONAL (US) 2021-07-01 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-20230117592-A1 LIPOXYGENASE INHIBITORS ALOX15B, ALOX12, ALOX5 MEN1 4539/4885KMT2A 2591/4885MAPT 2110/4885

“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.