Cyclopentane

Cyclopentane

SCHEMBL9788411

C1CCCC1.C1CCCC1.N#CO.N#CO

nearest known ligand 0.67

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Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.67
▸ CA2 P00918 1/20 0.67
▸ CA5A P35218 1/20 0.67
▸ CA9 Q16790 1/20 0.67
▸ CA5B Q9Y2D0 1/20 0.67
▸ ALDH1A1 P00352 1/20 0.39

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
Cyclohexane SCHEMBL3764306 1.00 — —
Cyclopropane SCHEMBL19371505 1.00 — —
Cyclopropane SCHEMBL27892383 1.00 — —
Cyclohexane SCHEMBL3764309 1.00 CA1 (0.67) CA1CA2CA5ACA9CA5B
Cyclohexane SCHEMBL27702287 0.82 ALDH1A1 (0.41) CA1CA2CA5ACA9CA5B
Cyclopropane SCHEMBL27702453 0.82 — —
Cyanate SCHEMBL11311543 0.82 — —
Cyanate SCHEMBL3699783 0.82 — —
Cyanate SCHEMBL19680 0.82 — —
Cyanate SCHEMBL476210 0.82 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5045381-A Containing (iso)cyanate compound and poly(p-hydroxystyrene) derivative HITACHI, LTD. (JP) 1991-09-03 — — US disclosed
EP-0364785-A1 Thermosetting resin composition, printed circuit board using the resin composition and process for producing printed circuit board HITACHI, LTD. (JP) 1990-04-25 — — EP disclosed
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