SCHEMBL23853043

SCHEMBL23853043

ClCCCN1CCN(CCCCl)CC1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.43
ALOX15 P16050 1/20 0.40
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SIGMAR1 Q99720 1/20 0.37
ACE2 Q9BYF1 1/20 0.36
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 1/20 0.36
CCR3 P51677 1/20 0.35

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
SCHEMBL3412350 1.00
SCHEMBL10552270 0.94 HRH3 (0.39) HRH3ALOX15ALDH1A1TSHRTDP1
Hydrochloric Acid SCHEMBL28996755 0.91 HRH3 (0.38) HRH3ALOX15TDP1SIGMAR1GNAI3
Hydrochloric Acid SCHEMBL846153 0.91 HRH3 (0.38) HRH3ALOX15TDP1SIGMAR1GNAI3
SCHEMBL16335517 0.89 HRH3 (0.55) HRH3
SCHEMBL167231 0.89 PAOX (0.47) HRH3ALDH1A1SIGMAR1
SCHEMBL73078 0.88
SCHEMBL23852715 0.88 ALDH1A1 (0.33) HRH3ALOX15ALDH1A1TSHRTDP1
SCHEMBL4294963 0.87 MAPK1 (0.43) SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL3450930 0.87 GNAI3 (0.43) ALDH1A1TSHRTDP1SIGMAR1GNAI3

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 HRH3 2908/4885ALOX15 26/4885ALDH1A1 83/4885
US-20220056182-A1 Modifier, Modified Conjugated Diene-Based Polymer Comprising Thereof and Method for Preparing the Polymer CAD, FN1, DHPS HRH3 2908/4885ALOX15 26/4885ALDH1A1 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.