SCHEMBL10659482

SCHEMBL10659482

C=C(N(CCCCC)CCCCC)N(CCCCC)CCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.50
CA1 P00915 4/20 0.50
CA9 Q16790 4/20 0.50
CA2 P00918 2/20 0.50
MGLL Q99685 1/20 0.45
DNM1 Q05193 3/20 0.43
ALDH1A1 P00352 2/20 0.41
ALDH2 P05091 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
MMP8 P22894 1/20 0.38
TSHR P16473 2/20 0.37
THRB P10828 1/20 0.37
GBA1 P04062 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 2/20 0.35
HSD17B10 Q99714 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
SCHEMBL10662124 0.97 CA12 (0.54) CA12CA1CA9CA2MGLL
SCHEMBL10666369 0.97 CA12 (0.54) CA12CA1CA9CA2MGLL
SCHEMBL10665872 0.97 CA12 (0.54) CA12CA1CA9CA2MGLL
SCHEMBL10664150 0.92 CA12 (0.48) CA12CA1CA9CA2MGLL
SCHEMBL11221777 0.81 CA12 (0.52) CA12CA1CA9CA2MGLL
SCHEMBL10664597 0.79 CA12 (0.48) CA12CA1CA9CA2ALDH1A1
SCHEMBL26042369 0.77 CA12 (0.45) CA12CA1CA9CA2MGLL
SCHEMBL19228775 0.77 MGLL (0.50) CA12CA1CA9CA2MGLL
SCHEMBL27357618 0.77 CA12 (0.50) CA12CA1CA9CA2MGLL
SCHEMBL12506396 0.75 CA12 (0.43) CA12CA1CA9CA2MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3345945-B1 MODIFIED MONOMER, MODIFIED CONJUGATED DIENE-BASED POLYMER COMPRISING SAME, AND METHOD FOR PREPARING SAME LG CHEMICAL LTD (KR) 2022-11-30 EP disclosed
US-10662143-B2 Modification monomer, modified conjugated diene-based polymer including the same and method for preparing the polymer LG CHEM, LTD. (KR) 2020-05-26 US disclosed
US-20190071390-A1 MODIFICATION MONOMER, MODIFIED CONJUGATED DIENE-BASED POLYMER INCLUDING THE SAME AND METHOD FOR PREPARING THE POLYMER LG CHEM, LTD. (KR) 2019-03-07 US disclosed
EP-3345945-A1 MODIFIED MONOMER, MODIFIED CONJUGATED DIENE-BASED POLYMER COMPRISING SAME, AND METHOD FOR PREPARING SAME LG Chem, Ltd. (KR) 2018-07-11 EP disclosed
US-4719245-A TRIMERIZATION CATALYST THE DOW CHEMICAL COMPANY (US) 1988-01-12 US disclosed
US-4703099-A CATALYTICALLY TRIMERIZING ISOCYANATES THE DOW CHEMICAL COMPANY (US) 1987-10-27 US disclosed
US-4632989-A KETENE AMINAL-OLEFIN REACTION PRODUCT AS CATALYSTS THE DOW CHEMICAL COMPANY (US) 1986-12-30 US disclosed
US-4536490-A REACTION PRODUCT OF KETENE-AMINAL AND UNSATURATED COMPOUND THE UPJOHN COMPANY (US) 1985-08-20 US disclosed
US-4342841-A Polyamide polyurethane prepared by reaction of polyisocyanate with a 1,1-diamino ethylene THE UPJOHN COMPANY (US) 1982-08-03 US disclosed
US-4338428-A Novel polyamides from ketene-aminals THE UPJOHN COMPANY (US) 1982-07-06 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-10662143-B2 Modification monomer, modified conjugated diene-based polymer including the same and method for preparing the polymer NOTUM, CARM1, FAR1 CA12 1366/4885CA1 2278/4885CA9 3205/4885
US-20190071390-A1 MODIFICATION MONOMER, MODIFIED CONJUGATED DIENE-BASED POLYMER INCLUDING THE SAME AND METHOD FOR PREPARING THE POLYMER NOTUM, CARM1, FAR1 CA12 1366/4885CA1 2278/4885CA9 3205/4885

“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.