SCHEMBL14948730

SCHEMBL14948730

OCC(OC1CCOCC1)c1ccccc1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.39
SLC6A4 P31645 2/20 0.37
CYP2D6 P10635 1/20 0.37
SLC6A2 P23975 1/20 0.37
KCNH2 Q12809 1/20 0.37
ACACB O00763 4/20 0.36
GAA P10253 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
ACP3 P15309 1/20 0.34
CNR2 P34972 1/20 0.34
ACACA Q13085 4/20 0.34
SOS1 Q07889 2/20 0.33
P2RX4 Q99571 1/20 0.33
AKR1C3 P42330 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
SCHEMBL18137727 0.83 ACACB (0.39) ACACBCNR2ACACA
SCHEMBL14945583 0.82 ACACB (0.35) ACACBACACA
SCHEMBL26325733 0.82 ACACB (0.35) ACACBACACA
SCHEMBL14945409 0.81 DPP4 (0.40) ACACBACACA
SCHEMBL14945449 0.81 ACACB (0.38) ACACBACACA
SCHEMBL14945457 0.81 ACACB (0.38) ACACBACACA
SCHEMBL14945398 0.80 ACACB (0.47) ACACBACACA
SCHEMBL29642175 0.80 ACACB (0.47) ACACBACACA
SCHEMBL14945397 0.80 ACACB (0.47) ACACBACACA
SCHEMBL21816549 0.80 ACACB (0.47) ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10472374-B2 ACC inhibitors and uses thereof GILEAD APOLLO, LLC (US) 2019-11-12 US disclosed
US-20190016732-A1 ACC INHIBITORS AND USES THEREOF Nimbus Apollo, Inc. 2019-01-17 US disclosed
US-20150203510-A1 ACC INHIBITORS AND USES THEREOF GILEAD APOLLO, LLC 2015-07-23 US disclosed
US-8969557-B2 ACC inhibitors and uses thereof Nimbus Apollo, Inc. (US) 2015-03-03 US disclosed
WO-2013071169-A1 ACC INHIBITORS AND USES THEREOF Nimbus Apollo, Inc. (US) 2013-05-16 WO disclosed
US-20130123231-A1 ACC INHIBITORS AND USES THEREOF Nimbus Apollo, Inc. (US) 2013-05-16 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 (4 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-20150203510-A1 ACC INHIBITORS AND USES THEREOF ACACA, ACACB, ACAT2 SYK 4150/4885SLC6A4 4169/4885CYP2D6 2306/4885
US-10472374-B2 ACC inhibitors and uses thereof ACACA, ACACB, ACAT2 SYK 4150/4885SLC6A4 4169/4885CYP2D6 2306/4885
US-20190016732-A1 ACC INHIBITORS AND USES THEREOF ACACA, ACACB, ACAT2 SYK 4150/4885SLC6A4 4169/4885CYP2D6 2306/4885
US-20130123231-A1 ACC INHIBITORS AND USES THEREOF ACACA, ACACB, ACAT2 SYK 4150/4885SLC6A4 4169/4885CYP2D6 2306/4885

“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.