SCHEMBL7545698

SCHEMBL7545698

C=C(C#N)C(=O)OCCCCOCC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.65
TSHR P16473 5/20 0.65
THRB P10828 1/20 0.49
CYP2C9 P11712 1/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 2/20 0.33
LMNA P02545 1/20 0.33
DNM1 Q05193 1/20 0.33
KDM4E B2RXH2 3/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
PKM P14618 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.32
NAAA Q02083 1/20 0.32
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31

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
SCHEMBL11285683 0.97 TSHR (0.61) ALDH1A1TSHRTHRBCYP2C9KMT2A
SCHEMBL4888155 0.97 ALDH1A1 (0.65) ALDH1A1TSHRTHRBCYP2C9KMT2A
SCHEMBL21932802 0.95 TSHR (0.62) ALDH1A1TSHRTHRBCYP2C9KMT2A
SCHEMBL450203 0.89 TSHR (0.69) ALDH1A1TSHRTHRBCYP2C9KMT2A
SCHEMBL4892534 0.88 TSHR (0.58) ALDH1A1TSHRTHRBKMT2AMAPT
SCHEMBL11279786 0.88 TSHR (0.67) ALDH1A1TSHRTHRBCYP2C9KMT2A
SCHEMBL28722802 0.88 TSHR (0.67) ALDH1A1TSHRTHRBCYP2C9KMT2A
SCHEMBL4580407 0.87 TSHR (0.63) ALDH1A1TSHRTHRBPOLBDNM1
Enbucrilate SCHEMBL11173752 0.86 TSHR (0.56) ALDH1A1TSHRTHRBKMT2AMAPT
SCHEMBL618797 0.86 TSHR (0.63) ALDH1A1TSHRLMNANPSR1NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105079856-B A kind of cyanoacrylate medical adhesive and its production and use 沈伟 2017-12-01 CN claimed
CN-105079856-A Novel cyanoacrylate medical adhesive as well as preparation method and application thereof SHEN WEI 2015-11-25 CN claimed
US-20020065314-A1 COMPOSITIONS AND METHOD FOR STIMULATING HAIR GROWTH S.N. BIOTECH, INC. 2002-05-30 US claimed
EP-0824316-A4 COMPOSITIONS AND METHODS FOR STIMULATING HAIR GROWTH NIELSEN THOR B (US) 2001-01-17 EP claimed
US-5767152-A USING A CYANOCARBOXYLIC ACID S.N. BIOTECH, INC. 1998-06-16 US claimed
EP-0824316-A1 COMPOSITIONS AND METHODS FOR STIMULATING HAIR GROWTH Nielsen, Thor, B. (US) 1998-02-25 EP claimed
WO-1996034526-A1 COMPOSITIONS AND METHODS FOR STIMULATING HAIR GROWTH NIELSEN THOR B (US) 1996-11-07 WO claimed
US-11629262-B2 Liquid composition set, cured product forming method, and liquid composition RICOH COMPANY, LTD. (JP) 2023-04-18 US disclosed
CN-115362230-A Low odor cyanoacrylate compositions 汉高股份有限及两合公司 2022-11-18 CN disclosed
CN-114796591-A Cyanoacrylate medical adhesive and preparation method and application thereof 北京康派特医疗器械有限公司 2022-07-29 CN disclosed
US-20210102081-A1 LIQUID COMPOSITION SET, CURED PRODUCT FORMING METHOD, AND LIQUID COMPOSITION RICOH COMPANY, LTD. (JP) 2021-04-08 US disclosed
CN-105079856-B A kind of cyanoacrylate medical adhesive and its production and use 沈伟 2017-12-01 CN disclosed
CN-105079856-A Novel cyanoacrylate medical adhesive as well as preparation method and application thereof SHEN WEI 2015-11-25 CN disclosed
US-20020065314-A1 COMPOSITIONS AND METHOD FOR STIMULATING HAIR GROWTH S.N. BIOTECH, INC. 2002-05-30 US disclosed
US-5767152-A USING A CYANOCARBOXYLIC ACID S.N. BIOTECH, INC. 1998-06-16 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 (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-20020065314-A1 COMPOSITIONS AND METHOD FOR STIMULATING HAIR GROWTH AREG, NGF, HDGF ALDH1A1 3677/4885TSHR 148/4885THRB 54/4885

“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.