SCHEMBL18855865

SCHEMBL18855865

C1CCC(OCC2CC2)C1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
CTSK P43235 1/20 0.48
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
NPC1 O15118 1/20 0.39
EPHX2 P34913 1/20 0.36
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
LMNA P02545 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
SCHEMBL4346290 0.97 CTSL (0.52) CTSLCTSBCTSKJAK2JAK1
SCHEMBL11814690 0.92 CTSL (0.57) CTSLCTSBCTSKJAK2JAK1
SCHEMBL22449348 0.92 CTSL (0.57) CTSLCTSBCTSKJAK2JAK1
SCHEMBL8640188 0.92 CTSL (0.57) CTSLCTSBCTSKJAK2JAK1
SCHEMBL2700673 0.92 CTSL (0.57) CTSLCTSBCTSKJAK2JAK1
SCHEMBL18561604 0.88 CTSL (0.46) CTSLCTSBCTSKJAK2JAK1
SCHEMBL31093863 0.88
SCHEMBL24445851 0.86 CTSL (0.44) CTSLCTSBCTSKJAK2JAK1
SCHEMBL9425975 0.86 CTSL (0.44) CTSLCTSBCTSKJAK2JAK1
SCHEMBL28832774 0.86 CTSL (0.57) CTSLCTSBCTSKJAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3950692-A1 NOVEL TRICYCLIC COMPOUNDS AbbVie Inc. (US) 2022-02-09 EP disclosed
EP-3636627-B1 NOVEL CYCLOPROPYLMETHOXY DERIVATIVES INT FLAVORS & FRAGRANCES INC (US) 2021-12-15 EP disclosed
EP-3636627-B1 NOVEL CYCLOPROPYLMETHOXY DERIVATIVES INT FLAVORS & FRAGRANCES INC (US) 2021-12-15 EP disclosed
US-11111458-B2 Cyclopropylmethoxy derivatives INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2021-09-07 US disclosed
US-11111458-B2 Cyclopropylmethoxy derivatives INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2021-09-07 US disclosed
CN-111018680-A Novel cyclopropyl methoxy derivative 国际香料和香精公司 2020-04-17 CN disclosed
US-20200115652-A1 NOVEL CYCLOPROPYLMETHOXY DERIVATIVES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2020-04-16 US disclosed
EP-3636627-A1 NOVEL CYCLOPROPYLMETHOXY DERIVATIVES International Flavors & Fragrances Inc. (US) 2020-04-15 EP disclosed
US-9884860-B2 Fused pyrroledicarboxamides and their use as pharmaceuticals SANOFI (FR) 2018-02-06 US disclosed
EP-2506716-B1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC (US) 2017-05-17 EP disclosed
US-20160159793-A1 Fused Pyrroledicarboxamides and Their Use as Pharmaceuticals SANOFI (FR) 2016-06-09 US disclosed
US-9284333-B2 Fused pyrroledicarboxamides and their use as pharmaceuticals SANOFI (FR) 2016-03-15 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 (3 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-11111458-B2 Cyclopropylmethoxy derivatives TRPA1, TRPV1, CBR3 CTSL 4305/4885CTSB 3084/4885CTSK 2908/4885
US-20200115652-A1 NOVEL CYCLOPROPYLMETHOXY DERIVATIVES TRPA1, TRPV1, OR51E2 CTSL 4431/4885CTSB 3642/4885CTSK 3423/4885
US-20160159793-A1 Fused Pyrroledicarboxamides and Their Use as Pharmaceuticals KCNA1, KCNE1, KCNH1 CTSL 3634/4885CTSB 4341/4885CTSK 3539/4885

“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.