SCHEMBL5455161

SCHEMBL5455161

ClC(Cl)/C=C/c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.50
CYP1A2 P05177 2/20 0.47
CNR2 P34972 1/20 0.43
ALDH1A1 P00352 3/20 0.42
LMNA P02545 3/20 0.42
MAPK1 P28482 2/20 0.42
NFE2L2 Q16236 1/20 0.42
CYP19A1 P11511 1/20 0.42
MAOA P21397 1/20 0.42
TRPA1 O75762 1/20 0.42
ALOX5 P09917 1/20 0.42
MAPT P10636 3/20 0.41
RECQL P46063 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HDAC3 O15379 1/20 0.41
TNKS O95271 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HCAR2 Q8TDS4 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
SCHEMBL148999 1.00 MAOB (0.50) MAOBCYP1A2CNR2ALDH1A1LMNA
SCHEMBL18320470 0.85 MAOB (0.46) MAOBCYP1A2CNR2ALDH1A1LMNA
(Z)-1,2-Diphenylethene SCHEMBL1892117 0.80 MAOB (0.58) MAOBALDH1A1NFE2L2CYP19A1MAOA
SCHEMBL7379003 0.80 CYP1A2 (0.48) MAOBCYP1A2CNR2ALDH1A1LMNA
SCHEMBL3862905 0.80 CYP1A2 (0.48) MAOBCYP1A2CNR2ALDH1A1LMNA
SCHEMBL3424706 0.80 MAOB (0.46) MAOBCYP1A2CNR2ALDH1A1LMNA
SCHEMBL7379006 0.80 CYP1A2 (0.48) MAOBCYP1A2CNR2ALDH1A1LMNA
SCHEMBL13420202 0.80 CYP1A2 (0.48) MAOBCYP1A2CNR2ALDH1A1LMNA
SCHEMBL10574618 0.80 MAOB (0.46) MAOBCYP1A2LMNAMAPK1TRPA1
SCHEMBL5165697 0.80 MAOB (0.46) MAOBCYP1A2LMNAMAPK1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1231558-C Alignment layer material for liquid crystal display and method for manufacturing the same CHANGXING CHEMICAL INDUSTRY CO (CN) 2005-12-14 CN claimed
CN-1504538-A Alignment layer material for liquid crystal display and method for manufacturing the same 长兴化学工业股份有限公司 2004-06-16 CN claimed
CN-1504537-A Alignment layer material for liquid crystal display and method for manufacturing the same 长兴化学工业股份有限公司 2004-06-16 CN claimed
CN-102762541-B Diaza derivatives as modulators of chemokine receptors HOFFMAN-LA ROCHE LTD. (CH) 2016-03-16 CN disclosed
CN-103396403-B Pesticidal compound SYNGENTA PARTICIPATIONS AG (CH) 2015-09-09 CN disclosed
US-20070225269-A1 Use of (3-(1-(3-Phenyl-Propenyl)-Piperidin-4-Yl)-2,3-Dihydro-Indol-1-Yl)-(Pyridin-4-Yl)-Methanonone Derivatives and Related Compounds as Insecticides SYNGENTA CROP PROTECTION, INC. 2007-09-27 US disclosed
CN-1231558-C Alignment layer material for liquid crystal display and method for manufacturing the same CHANGXING CHEMICAL INDUSTRY CO (CN) 2005-12-14 CN disclosed
CN-1504537-A Alignment layer material for liquid crystal display and method for manufacturing the same 长兴化学工业股份有限公司 2004-06-16 CN disclosed
CN-1504538-A Alignment layer material for liquid crystal display and method for manufacturing the same 长兴化学工业股份有限公司 2004-06-16 CN disclosed
CN-1128797-C Farnesyl transferase inhibiting 1,8-annelated quinolinone derivs. substd. with N- or C-linked imidazoles JANSSEN PHARMACEUTICA NV (BE) 2003-11-26 CN disclosed
CN-1249753-A N-or C-bonded imidazole-substituted 1, 8-fused quinolinone derivatives inhibiting Farnesyl transferase JANSSEN PHARMACEUTICA NV (BE) 2000-04-05 CN 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-20070225269-A1 Use of (3-(1-(3-Phenyl-Propenyl)-Piperidin-4-Yl)-2,3-Dihydro-Indol-1-Yl)-(Pyridin-4-Yl)-Methanonone Derivatives and Related Compounds as Insecticides CHRM1, NPY1R, MRM1 MAOB 1889/4885CYP1A2 448/4885CNR2 383/4885

“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.