SCHEMBL13846403

SCHEMBL13846403

C/C(=C/C(=O)c1ccccc1)Nc1ccccc1Oc1ccc(Br)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.58
▸ ALDH1A1 P00352 5/20 0.58
▸ MAPK1 P28482 5/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ HTT P42858 1/20 0.58
▸ RAB9A P51151 7/20 0.57
▸ NPC1 O15118 6/20 0.57
▸ SMN1; SMN2 Q16637 4/20 0.53
▸ LMNA P02545 4/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ GAA P10253 2/20 0.47
▸ THRB P10828 1/20 0.47
▸ HPGD P15428 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ TSHR P16473 2/20 0.46
▸ NFKB1 P19838 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
SCHEMBL13846397 0.91 MAPT (0.60) MAPTALDH1A1MAPK1KMT2ARAB9A
SCHEMBL13846410 0.89 RAB9A (0.68) MAPTALDH1A1MAPK1KMT2AHTT
SCHEMBL15504786 0.89 MAPT (0.58) MAPTALDH1A1MAPK1KMT2AHTT
SCHEMBL13849752 0.89 MAPT (0.61) MAPTALDH1A1MAPK1KMT2AHTT
SCHEMBL13849747 0.88 MAPT (0.57) MAPTALDH1A1MAPK1KMT2AHTT
SCHEMBL13846402 0.86 MAPT (0.55) MAPTALDH1A1MAPK1KMT2AHTT
SCHEMBL13846404 0.84 MAPT (0.59) MAPTALDH1A1MAPK1KMT2AHTT
SCHEMBL13846411 0.80 MAPT (0.74) MAPTALDH1A1MAPK1KMT2AHTT
SCHEMBL13846398 0.79 MAPT (0.52) MAPTALDH1A1MAPK1KMT2AHTT
SCHEMBL13846399 0.78 MAPT (0.51) MAPTALDH1A1MAPK1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140073500-A1 CLASS OF ORGANIC COMPOUNDS CONTAINING HETEROATOM AND ITS APPLICATIONS IN PREPARING SINGLE-SITE ZIEGLER-NATTA CATALYST SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2014-03-13 — — US disclosed
US-20140073500-A1 CLASS OF ORGANIC COMPOUNDS CONTAINING HETEROATOM AND ITS APPLICATIONS IN PREPARING SINGLE-SITE ZIEGLER-NATTA CATALYST SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2014-03-13 — — US disclosed
US-20090137383-A1 CLASS OF ORGANIC COMPOUNDS CONTAINING HETEROATOM AND ITS APPLICATIONS IN PREPARING SINGLE-SITE ZIEGLER-NATTA CATALYST SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2009-05-28 — — 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-20140073500-A1 CLASS OF ORGANIC COMPOUNDS CONTAINING HETEROATOM AND ITS APPLICATIONS IN PREPARING SINGLE-SITE ZIEGLER-NATTA CATALYST CCNT1, SP1, CCNT2 MAPT 450/4885ALDH1A1 2171/4885MAPK1 2104/4885
US-20090137383-A1 CLASS OF ORGANIC COMPOUNDS CONTAINING HETEROATOM AND ITS APPLICATIONS IN PREPARING SINGLE-SITE ZIEGLER-NATTA CATALYST CCNT1, SP1, CCNT2 MAPT 450/4885ALDH1A1 2171/4885MAPK1 2104/4885

“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.

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