SCHEMBL5848639

SCHEMBL5848639

Cc1cc(C)c(O)c(C)c1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 4/20 0.46
GAA P10253 3/20 0.46
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
TSHR P16473 4/20 0.43
TP53 P04637 2/20 0.43
CYP3A4 P08684 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
PKM P14618 1/20 0.40
NPC1 O15118 1/20 0.39
MITF O75030 1/20 0.39
AGTR1 P30556 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
POLB P06746 2/20 0.39
MAPK1 P28482 1/20 0.38
CASP1 P29466 1/20 0.36

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
SCHEMBL10781847 0.82 ALDH1A1 (0.50) ALDH1A1KDM4EGAAMAPTLMNA
SCHEMBL28878856 0.82 ALDH1A1 (0.50) ALDH1A1KDM4EGAAMAPTLMNA
SCHEMBL262306 0.80 ALDH1A1 (0.56) ALDH1A1KDM4EGAAMAPTLMNA
SCHEMBL68382 0.80 CA1 (0.56) ALDH1A1KDM4EGAAMAPTLMNA
SCHEMBL687634 0.79 ALDH1A1 (0.43) ALDH1A1KDM4EGAAMAPTLMNA
SCHEMBL11085769 0.79 ALDH1A1 (0.46) ALDH1A1KDM4EGAAMAPTLMNA
Ammonia Solution, Strong SCHEMBL2045015 0.77 ALDH1A1 (0.53) ALDH1A1KDM4EGAAMAPTLMNA
Hydrochloric Acid SCHEMBL8643161 0.77 ALDH1A1 (0.53) ALDH1A1KDM4EGAAMAPTLMNA
SCHEMBL1096017 0.75 POLB (0.36) ALDH1A1KDM4EGAAMAPTLMNA
SCHEMBL394882 0.75 ALDH1A1 (0.50) ALDH1A1KDM4EGAAMAPTTSHR

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-115340838-A Epoxy resin adhesive for repairing building cracks and preparation method thereof 可慧(河南)新材料科技有限公司 2022-11-15 CN claimed
CN-114150823-A Roof waterproof structure 华能澜沧江水电股份有限公司 2022-03-08 CN claimed
CN-115340838-A Epoxy resin adhesive for repairing building cracks and preparation method thereof 可慧(河南)新材料科技有限公司 2022-11-15 CN disclosed
CN-113072686-B Preparation method of aldehyde-free waterborne cardanol ketone amine epoxy curing agent 上海经天新材料科技有限公司 2022-11-11 CN disclosed
CN-114150823-A Roof waterproof structure 华能澜沧江水电股份有限公司 2022-03-08 CN disclosed
CN-113072686-A Preparation method of aldehyde-free waterborne cardanol ketone amine epoxy curing agent 上海经天新材料科技有限公司 2021-07-06 CN disclosed
US-7037990-B2 Transition metal complexes in the controlled synthesis of polyolefins substituted with functional groups NIPPON SYNTHETIC CHEMICAL COMPANY (JP) 2006-05-02 US disclosed
WO-2004063229-A2 TRANSITION METAL COMPLEXES IN THE CONTROLLED SYNTHESIS OF POLYOLEFINS SUBSTITUTED WITH FUNCTIONAL GROUPS THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) 2004-07-29 WO disclosed
US-20040132936-A1 Transition metal complexes in the controlled synthesis of polyolefins substituted with functional groups NIPPON SYNTHETIC CHEMICAL COMPANY (JP) 2004-07-08 US disclosed
US-20040132610-A1 Transition metal complexes in the controlled synthesis of polyolefins substituted with functional groups SRI INTERNATIONAL 2004-07-08 US disclosed
US-4551215-A EPOXY COMPOUND, PHOTOPOLYMERIZABLE COMPOUND HAVING CARBOXYL, AND PHOTOSENSITIZER TOYO BOSEKI KABUSHIKI KAISHA (JP) 1985-11-05 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-20040132610-A1 Transition metal complexes in the controlled synthesis of polyolefins substituted with functional groups ADH1C, ELOVL6, TRRAP ALDH1A1 456/4885KDM4E 847/4885GAA 3681/4885
US-20040132936-A1 Transition metal complexes in the controlled synthesis of polyolefins substituted with functional groups ADH1C, ELOVL6, TRRAP ALDH1A1 456/4885KDM4E 847/4885GAA 3681/4885

“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.