SCHEMBL3486548

SCHEMBL3486548

C=C(C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)CC(=O)CCCCCCCCCCCCC)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CETP P11597 1/20 0.61
▸ PRKCD Q05655 1/20 0.60
▸ PTGES O14684 2/20 0.59
▸ PTPN1 P18031 2/20 0.57
▸ CES2 O00748 1/20 0.57
▸ TOP2A P11388 1/20 0.57
▸ CES1 P23141 1/20 0.57
▸ CA9 Q16790 2/20 0.55
▸ NT5E P21589 4/20 0.54
▸ NR1H4 Q96RI1 1/20 0.54

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
SCHEMBL564481 0.94 CETP (0.69) CETPPRKCDPTGESPTPN1CES2
SCHEMBL564480 0.94 CETP (0.69) CETPPRKCDPTGESPTPN1CES2
SCHEMBL6741284 0.88 PRKCD (0.75) CETPPRKCDPTGESPTPN1CES2
Lupeol Linoleate SCHEMBL935903 0.87 CETP (0.61) CETPPRKCDPTGESPTPN1CES2
Lupeol Linoleate SCHEMBL935900 0.87 CETP (0.61) CETPPRKCDPTGESPTPN1CES2
SCHEMBL15496672 0.87 CETP (0.69) CETPPRKCDPTGESPTPN1CES2
SCHEMBL28690606 0.86 CETP (0.57) CETPPRKCDPTGESPTPN1CES2
SCHEMBL5956741 0.85 CETP (0.82) CETPPRKCDPTGESPTPN1CES2
SCHEMBL5956717 0.85 PRKCD (0.81) CETPPRKCDPTGESPTPN1CES2
SCHEMBL6741278 0.85 PRKCD (0.81) CETPPRKCDPTGESPTPN1CES2

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
US-20090081119-A1 INHIBITING DNA POLYMERASE BETA TO ENHANCE EFFICACY OF ANTICANCER AGENTS UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2009-03-26 — — US claimed
WO-2007001684-A9 INHIBITING DNA POLYMERASE BETA TO ENHANCE EFFICACY OF ANTICANCER AGENTS UNIV PITTSBURGH (US) 2007-04-19 — — WO claimed
WO-2007001684-A2 INHIBITING DNA POLYMERASE BETA TO ENHANCE EFFICACY OF ANTICANCER AGENTS UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2007-01-04 — — WO claimed
US-20100048682-A1 INHIBITING DNA POLYMERASE BETA TO ENHANCE EFFICACY OF ANTICANCER AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2010-02-25 — — US disclosed
US-20090081119-A1 INHIBITING DNA POLYMERASE BETA TO ENHANCE EFFICACY OF ANTICANCER AGENTS UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2009-03-26 — — US disclosed
WO-2007001684-A9 INHIBITING DNA POLYMERASE BETA TO ENHANCE EFFICACY OF ANTICANCER AGENTS UNIV PITTSBURGH (US) 2007-04-19 — — WO disclosed
WO-2007001684-A2 INHIBITING DNA POLYMERASE BETA TO ENHANCE EFFICACY OF ANTICANCER AGENTS UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2007-01-04 — — WO disclosed
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