SCHEMBL13825845

SCHEMBL13825845

O=C(O)[C@H]1[C@@H]2CC/C=C/CC[C@@H]21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 5/20 0.44
▸ TDP1 Q9NUW8 3/20 0.44
▸ APEX1 P27695 1/20 0.44
▸ RAB9A P51151 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ TFPI2 P48307 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ GMNN O75496 1/20 0.39
▸ PMP22 Q01453 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ THPO P40225 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ CTDSP1 Q9GZU7 1/20 0.35
▸ GRM8 O00222 1/20 0.33
▸ GRM6 O15303 1/20 0.33
▸ GRM2 Q14416 1/20 0.33
▸ GRM3 Q14832 1/20 0.33

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
SCHEMBL13825844 1.00 POLB (0.44) POLBTDP1APEX1RAB9ANPC1
SCHEMBL20445748 1.00 POLB (0.44) POLBTDP1APEX1RAB9ANPC1
SCHEMBL13684505 1.00 POLB (0.44) POLBTDP1APEX1RAB9ANPC1
SCHEMBL30864790 1.00 POLB (0.44) POLBTDP1APEX1RAB9ANPC1
SCHEMBL13684506 1.00 POLB (0.44) POLBTDP1APEX1RAB9ANPC1
SCHEMBL13684727 1.00 POLB (0.44) POLBTDP1APEX1RAB9ANPC1
SCHEMBL25585142 0.95 POLB (0.44) POLBTDP1APEX1RAB9ANPC1
SCHEMBL25497599 0.84 RAB9A (0.38) POLBTDP1APEX1RAB9ANPC1
SCHEMBL12231001 0.80 POLB (0.48) POLBTDP1APEX1RAB9AKDM4E
SCHEMBL26718276 0.80 PPM1B (0.49) POLBTDP1APEX1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3357903-B1 METHOD FOR A CONTINUOUS PRODUCTION OF A Z-CYCLOOCTENE STICHTING KATHOLIEKE UNIV (NL) 2020-11-04 — — EP disclosed
EP-3357903-A1 METHOD AND SYSTEM FOR A CONTINUOUS PRODUCTION OF A Z-CYCLOOCTENE Stichting Katholieke Universiteit (NL) 2018-08-08 — — EP disclosed
EP-2522369-A1 Pretargeting kit, method and agents used therein Koninklijke Philips Electronics N.V. (NL) 2012-11-14 — — EP disclosed
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