SCHEMBL23853045

SCHEMBL23853045

ClCCCN1C=CN(CCCCl)C=C1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
ALDH1A1 P00352 1/20 0.38
SLC9A1 P19634 1/20 0.30
CSNK2A2 P19784 1/20 0.30
CSNK2B P67870 1/20 0.30
CSNK2A1 P68400 1/20 0.30
CSNK2A3 Q8NEV1 1/20 0.30

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
SCHEMBL14980604 0.69
SCHEMBL30440709 0.67 ALDH1A1 (0.32) TSHRTDP1ALDH1A1
SCHEMBL4270831 0.63 TSHR (0.47) TSHRALDH1A1
SCHEMBL4270037 0.63 TSHR (0.47) TSHRALDH1A1
Hydrochloric Acid SCHEMBL5617830 0.63
SCHEMBL2813982 0.63
Hydrochloric Acid SCHEMBL28907425 0.61 TP53 (0.39) TSHRTDP1ALDH1A1SLC9A1
SCHEMBL31364414 0.61
SCHEMBL23853043 0.60 HRH3 (0.43) TSHRTDP1ALDH1A1
SCHEMBL3412350 0.60

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3885379-B1 MODIFYING AGENT, MODIFIED CONJUGATED DIENE-BASED POLYMER INCLUDING SAME AND METHOD FOR PREPARING POLYMER LG CHEMICAL LTD (KR) 2025-01-15 EP disclosed
US-12116439-B2 Modifier, modified conjugated diene-based polymer comprising thereof and method for preparing the polymer LG CHEM, LTD. (KR) 2024-10-15 US disclosed
CN-113195550-B Modifier, modified conjugated diene polymer containing the modifier, and method for producing the polymer 株式会社LG化学 2023-03-28 CN disclosed
US-20220056182-A1 Modifier, Modified Conjugated Diene-Based Polymer Comprising Thereof and Method for Preparing the Polymer LG CHEM, LTD. (KR) 2022-02-24 US disclosed
EP-3885379-A1 MODIFYING AGENT, MODIFIED CONJUGATED DIENE-BASED POLYMER INCLUDING SAME AND METHOD FOR PREPARING POLYMER LG Chem, Ltd. (KR) 2021-09-29 EP 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-12116439-B2 Modifier, modified conjugated diene-based polymer comprising thereof and method for preparing the polymer CAD, FN1, DHPS TSHR 3623/4885TDP1 1005/4885ALDH1A1 83/4885
US-20220056182-A1 Modifier, Modified Conjugated Diene-Based Polymer Comprising Thereof and Method for Preparing the Polymer CAD, FN1, DHPS TSHR 3623/4885TDP1 1005/4885ALDH1A1 83/4885

“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.