SCHEMBL2552707

SCHEMBL2552707

CCCCOCCCCOCCCCO

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.75
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
THRB P10828 1/20 0.65
HTT P42858 1/20 0.65
MAPT P10636 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.58
LMNA P02545 2/20 0.55
ALDH1A1 P00352 2/20 0.55
HSD17B10 Q99714 1/20 0.55
CYP4F2 P78329 1/20 0.46
CYP4A11 Q02928 1/20 0.46
USP2 O75604 1/20 0.45
CYP3A4 P08684 1/20 0.44
ACHE P22303 6/20 0.44

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
SCHEMBL2956594 1.00 TSHR (0.75) TSHRMEN1KMT2ATHRBHTT
SCHEMBL3064578 1.00 TSHR (0.75) TSHRMEN1KMT2ATHRBHTT
SCHEMBL18086628 1.00 TSHR (0.75) TSHRMEN1KMT2ATHRBHTT
SCHEMBL223964 1.00 TSHR (0.75) TSHRMEN1KMT2ATHRBHTT
SCHEMBL874676 0.97 TSHR (0.71) TSHRMEN1KMT2ATHRBHTT
SCHEMBL2532324 0.97 TSHR (0.71) TSHRMEN1KMT2ATHRBHTT
SCHEMBL4392282 0.97 TSHR (0.71) TSHRMEN1KMT2ATHRBHTT
SCHEMBL5434893 0.97 TSHR (0.71) TSHRMEN1KMT2ATHRBHTT
SCHEMBL9083720 0.97 TSHR (0.71) TSHRMEN1KMT2ATHRBHTT
SCHEMBL822812 0.97 TSHR (0.71) TSHRMEN1KMT2ATHRBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114671639-B Blending agent for resisting concrete shrinkage cracks of bridge guardrail and preparation method thereof 安徽省路港工程有限责任公司 2023-03-21 CN claimed
CN-114671639-A Blending agent for resisting concrete shrinkage cracks of bridge guardrail and preparation method thereof 安徽省路港工程有限责任公司 2022-06-28 CN claimed
EP-2392314-B1 OILY HAIR COSMETIC KOKYU ALCOHOL KOGYO CO LTD (JP) 2019-08-14 EP claimed
CN-103037689-B Insecticidal composition JIANGSU ROTAM CHEMISTRY Co.,Ltd. (CN) 2014-10-08 CN claimed
CN-102651967-B Insecticide composition and method for controlling insects using same ROTAM AGROCHEM INT CO LTD 2014-09-10 CN claimed
CN-103037686-B Pesticidal Composition ROTAM AGROCHEM INT CO LTD 2014-07-23 CN claimed
US-8562957-B2 Oily hair cosmetics KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2013-10-22 US claimed
CN-103037689-A Insecticidal composition ROTAM AGROCHEM INT CO LTD 2013-04-10 CN claimed
CN-103037686-A Pesticidal Composition ROTAM AGROCHEM INT CO LTD 2013-04-10 CN claimed
CN-102651967-A Insecticide composition and method for controlling insects using same ROTAM AGROCHEM INT CO LTD 2012-08-29 CN claimed
WO-2011120427-A1 INSECTICIDE COMPOSITION AND METHOD OF CONTROLLING INSECTS USING THE SAME ROTAM AGROCHEM INTERNATIONAL CO., LTD (CN) 2011-10-06 WO claimed
US-20100203003-A1 Oily Hair Cosmetics KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2010-08-12 US claimed
US-7766978-B2 Acidic hair dyeing method KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2010-08-03 US claimed
US-20090100609-A1 ACIDIC HAIR DYE COMPOSITION KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2009-04-23 US claimed
US-7182841-B2 Purification of solvents used for the purification of alkylene oxide HUNTSMAN INTERNATIONAL LLC (US) 2007-02-27 US claimed
WO-2004094346-A2 PURIFICATION OF SOLVENTS USED FOR THE PURIFICATION OF ALKYLENE OXIDE HUNTSMAN INTERNATIONAL LLC (US) 2004-11-04 WO claimed
US-20040211658-A1 Purification of solvents used for the purification of alkylene oxide HUNTSMAN PETROCHEMICAL COMPANY 2004-10-28 US claimed
US-5133967-A Containing propylene and(or) butylene glycol ethers THE DOW CHEMICAL COMPANY (US) 1992-07-28 US claimed
US-4525512-A ALKYL DIGLYCOL ETHER ESTERS BP CHEMICALS LIMITED (GB) 1985-06-25 US claimed
EP-0119026-A2 Coalescing agents BP Chemicals Limited (GB) 1984-09-19 EP claimed

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-20090100609-A1 ACIDIC HAIR DYE COMPOSITION H1-0, MRM1, H1-4 TSHR 3886/4885MEN1 157/4885KMT2A 2163/4885
US-20100203003-A1 Oily Hair Cosmetics H1-0, H1-2, H1-3 TSHR 1973/4885MEN1 85/4885KMT2A 842/4885

“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.