SCHEMBL5169856

SCHEMBL5169856

Cc1c(C)c(C)c(C(=O)c2ccccc2)c(C)c1C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.62
HTT P42858 1/20 0.56
MAPT P10636 4/20 0.55
LMNA P02545 3/20 0.55
GFER P55789 1/20 0.54
ATM Q13315 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
SRD5A2 P31213 1/20 0.52
GRM6 O15303 1/20 0.50
HPGD P15428 2/20 0.49
PLA2G1B P04054 1/20 0.49
MAPK1 P28482 1/20 0.49
ATG4B Q9Y4P1 1/20 0.49
GAA P10253 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HSD17B10 Q99714 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
CES2 O00748 4/20 0.48

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
SCHEMBL377001 0.88 MAPT (0.54) ALDH1A1HTTMAPTLMNAGFER
SCHEMBL27514040 0.87 ALDH1A1 (0.52) ALDH1A1HTTMAPTLMNAGFER
SCHEMBL27527047 0.87 MAPT (0.58) ALDH1A1HTTMAPTLMNAGFER
Hydrochloric Acid SCHEMBL27544061 0.85 MAPT (0.56) ALDH1A1HTTMAPTLMNAGFER
SCHEMBL21694087 0.85 MAPT (0.58) ALDH1A1HTTMAPTLMNAGFER
SCHEMBL13836776 0.83 ALDH1A1 (0.48) ALDH1A1HTTMAPTLMNAGFER
SCHEMBL28501630 0.82 MAPT (0.51) ALDH1A1HTTMAPTLMNAGFER
SCHEMBL1039786 0.79 HTT (0.56) ALDH1A1HTTMAPTLMNAATM
Benzophenone SCHEMBL7454682 0.78 ALDH1A1 (0.88) ALDH1A1MAPTLMNAATMTDP1
SCHEMBL3039645 0.78 ALDH1A1 (0.59) ALDH1A1MAPTLMNAATMTDP1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114479735-A Cationic UV curing adhesive and preparation method and application thereof 张河远 2022-05-13 CN claimed
EP-0209831-B1 SUBSTITUTED BENZOPHENONES AND THEIR LIQUID MIXTURES SUITABLE FOR USE AS PHOTOPOLYMERISATION INITIATORS FRATELLI LAMBERTI S.p.A. (IT) 1990-05-16 EP claimed
US-4755541-A Substituted benzophenones and their liquid mixtures suitable for use as photopolymerization initiators FRATELLI LAMBERTI SPA (IT) 1988-07-05 US claimed
EP-0209831-A2 Substituted benzophenones and their liquid mixtures suitable for use as photopolymerisation initiators FRATELLI LAMBERTI S.p.A. (IT) 1987-01-28 EP claimed
CN-114479735-A Cationic UV curing adhesive and preparation method and application thereof 张河远 2022-05-13 CN disclosed
EP-1776100-B1 TREATMENT OF CANCER USING BENZOIC ACID DERIVATIVES UNIV NEW YORK (US) 2016-08-31 EP disclosed
US-9018259-B2 Treatment of cancer using benzoic acid derivatives NEW YORK UNIVERSITY (US) 2015-04-28 US disclosed
US-8512934-B2 Sulphonium salt initiators BASF SE (DE) 2013-08-20 US disclosed
US-20120329861-A1 TREATMENT OF CANCER USING BENZOIC ACID DERIVATIVES NEW YORK UNIVERSITY (US) 2012-12-27 US disclosed
US-8198328-B2 Treatment of cancer using benzoic acid derivatives NEW YORK UNIVERSITY (US) 2012-06-12 US disclosed
US-8067643-B2 Sulphonium salt initiators BASF SE (DE) 2011-11-29 US disclosed
US-20100297542-A1 SULPHONIUM SALT INITIATORS BASF SE (DE) 2010-11-25 US disclosed
EP-1776100-A2 TREATMENT OF CANCER USING BENZOIC ACID DERIVATIVES NEW YORK UNIVERSITY (US) 2007-04-25 EP disclosed
US-20050209334-A1 method of treating cancer using benzoic acid derivatives, alone or in combination with standard treatments such as chemotherapy and radiotherapy methods of screening for benzoic derivatives based on their ability to inhibit the enzyme tyrosinase or to bind to and activate PXR/SXR xenobiotic receptors. NEW YORK UNIVERSITY (US) 2005-09-22 US disclosed
WO-2005070024-A2 TREATMENT OF CANCER USING BENZOIC ACID DERIVATIVES NEW YORK UNIVERSITY (US) 2005-08-04 WO disclosed
US-5354784-A Photoinitiators for cationically polymerizable compounds ARAKAWA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1994-10-11 US disclosed
EP-0209831-B1 SUBSTITUTED BENZOPHENONES AND THEIR LIQUID MIXTURES SUITABLE FOR USE AS PHOTOPOLYMERISATION INITIATORS FRATELLI LAMBERTI S.p.A. (IT) 1990-05-16 EP disclosed
US-4755541-A Substituted benzophenones and their liquid mixtures suitable for use as photopolymerization initiators FRATELLI LAMBERTI SPA (IT) 1988-07-05 US disclosed
EP-0209831-A2 Substituted benzophenones and their liquid mixtures suitable for use as photopolymerisation initiators FRATELLI LAMBERTI S.p.A. (IT) 1987-01-28 EP disclosed
US-4071540-A MALEIC OR PHTHALIC CHEVRON RESEARCH COMPANY (US) 1978-01-31 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 (3 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-20100297542-A1 SULPHONIUM SALT INITIATORS CBR1, CBR3, NCOR1 ALDH1A1 2518/4885HTT 1409/4885MAPT 3855/4885
US-20050209334-A1 method of treating cancer using benzoic acid derivatives, alone or in combination with standard treatments such as chemotherapy and radiotherapy methods of screening for benzoic derivatives based on their ability to inhibit the enzyme tyrosinase or to bind to and activate PXR/SXR xenobiotic receptors. AHR, TYR, CYP4X1 ALDH1A1 598/4885HTT 3556/4885MAPT 3055/4885
US-20120329861-A1 TREATMENT OF CANCER USING BENZOIC ACID DERIVATIVES AHR, TYR, CYP4X1 ALDH1A1 453/4885HTT 3235/4885MAPT 2439/4885

“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.