SCHEMBL9716517

SCHEMBL9716517

CCCC[Sn](Cl)(CCC)CCCC

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.35
LMNA P02545 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
THRB P10828 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL8918984 1.00 TSHR (0.35) TSHRLMNATDP1THRBALDH1A1
SCHEMBL14157251 0.94 TSHR (0.40) TSHRLMNATDP1THRBALDH1A1
SCHEMBL1131 0.94 TSHR (0.40) TSHRLMNATDP1THRBALDH1A1
SCHEMBL10851813 0.90 TSHR (0.38) TSHRLMNATDP1THRBALDH1A1
SCHEMBL8911782 0.90 TSHR (0.38) TSHRLMNATDP1THRBALDH1A1
SCHEMBL25206988 0.90 TSHR (0.38) TSHRLMNATDP1THRBALDH1A1
Bromide SCHEMBL28239528 0.90 TSHR (0.38) TSHRLMNATDP1THRBALDH1A1
Phosphine SCHEMBL27559693 0.90 TSHR (0.38) TSHRLMNATDP1THRBALDH1A1
Hexane SCHEMBL4123692 0.90 TSHR (0.44) TSHRLMNATDP1THRBALDH1A1
SCHEMBL8555736 0.88 TSHR (0.35) TSHRLMNATDP1THRBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2763990-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2017-02-22 EP disclosed
EP-2763990-A1 PYRROLOPYRAZINE KINASE INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2014-08-13 EP disclosed
US-8658646-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LAROCHE INC. (US) 2014-02-25 US disclosed
WO-2013030138-A1 PYRROLOPYRAZINE KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2013-03-07 WO disclosed
US-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. 2013-03-07 US disclosed
EP-0247019-B1 ANTIFOULING AND ANTICORROSIVE COATING FOR UNDERWATER STRUCTURES FINA RESEARCH S.A. (BE) 1992-04-15 EP disclosed
EP-0247019-A2 Antifouling and anticorrosive coating for underwater structures FINA RESEARCH S.A. (BE) 1987-11-25 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 (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-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS SYK, ZAP70, JAK1 TSHR 2932/4885LMNA 4873/4885TDP1 619/4885

“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.