SCHEMBL21162500

SCHEMBL21162500

C=C(Cl)/C=C\c1ccc(C)cc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A1 P04798 1/20 0.47
▸ CYP1B1 Q16678 1/20 0.47
▸ TDP1 Q9NUW8 3/20 0.46
▸ LMNA P02545 3/20 0.46
▸ MAPT P10636 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ HSP90AA1 P07900 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ ALOX12 P18054 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ TP53 P04637 1/20 0.38
▸ GABRA1 P14867 1/20 0.37
▸ GABRG2 P18507 1/20 0.37
▸ GABRB3 P28472 1/20 0.37
▸ AMY1A P0DUB6 1/20 0.37

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
SCHEMBL10259134 0.81 CYP1A1 (0.47) CYP1A1CYP1B1TDP1LMNAMAPT
SCHEMBL294149 0.78 AMY1A (0.42) CYP1A1CYP1B1TDP1LMNAMAPT
SCHEMBL294148 0.78 AMY1A (0.42) CYP1A1CYP1B1TDP1LMNAMAPT
SCHEMBL16170090 0.77 CYP1A1 (0.43) CYP1A1CYP1B1TDP1LMNAMAPT
SCHEMBL6546420 0.77 AMY1A (0.47) CYP1A1CYP1B1TDP1LMNAMAPT
SCHEMBL11323718 0.77 AMY1A (0.47) CYP1A1CYP1B1TDP1LMNAMAPT
SCHEMBL17682919 0.77 TSHR (0.43) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL2865211 0.76 CYP1A1 (0.55) CYP1A1CYP1B1TDP1LMNAMAPT
SCHEMBL14303656 0.76 CYP1A1 (0.55) CYP1A1CYP1B1TDP1LMNAMAPT
SCHEMBL584565 0.76 CYP1A1 (0.55) CYP1A1CYP1B1TDP1LMNAMAPT

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-10633383-B2 Compounds for the treatment, alleviation or prevention of disorders associated with Tau aggregates AC IMMUNE SA (CH) 2020-04-28 — — US disclosed
US-20190211012-A1 Novel compounds for the treatment, alleviation or prevention of disorders associated with Tau aggregates AC IMMUNE SA (CH) 2019-07-11 — — 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-20190211012-A1 Novel compounds for the treatment, alleviation or prevention of disorders associated with Tau aggregates MAPT, MAP1LC3A, MAP1LC3B CYP1A1 4852/4885CYP1B1 4809/4885TDP1 308/4885
US-10633383-B2 Compounds for the treatment, alleviation or prevention of disorders associated with Tau aggregates MAPT, MAP1LC3A, TUBB3 CYP1A1 4816/4885CYP1B1 4768/4885TDP1 300/4885

“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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