SCHEMBL14948679

SCHEMBL14948679

CC(C)(CC1CCC(O)CC1)[Si](O)(c1ccccc1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 1/20 0.33
▸ TYRO3 Q06418 1/20 0.33
▸ MERTK Q12866 1/20 0.33
▸ CHRM3 P20309 4/20 0.33
▸ CHRM2 P08172 3/20 0.33
▸ CHRM1 P11229 3/20 0.33
▸ RIPK1 Q13546 1/20 0.32
▸ IDO1 P14902 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
SCHEMBL13631329 0.88 ESR1 (0.33) CHRM3CHRM2CHRM1RIPK1
SCHEMBL17086375 0.88 ESR1 (0.33) CHRM3CHRM2CHRM1RIPK1
SCHEMBL19575551 0.86 CHRM3 (0.34) AXLTYRO3MERTKCHRM3CHRM2
SCHEMBL12067807 0.86 F2 (0.33) AXLTYRO3MERTKCHRM3RIPK1
SCHEMBL14852948 0.86 F2 (0.33) AXLTYRO3MERTKCHRM3RIPK1
SCHEMBL10208829 0.86 OPRK1 (0.36) IDO1
SCHEMBL13631314 0.84 RIPK1 (0.30) RIPK1
SCHEMBL13631305 0.84 DGAT1 (0.36) CHRM2
SCHEMBL14948702 0.83 GBA1 (0.44) —
SCHEMBL13538035 0.83 CHRM3 (0.37) CHRM3CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160297834-A1 ACC INHIBITORS AND USES THEREOF GILEAD APOLLO, LLC 2016-10-13 — — US disclosed
US-8969557-B2 ACC inhibitors and uses thereof Nimbus Apollo, Inc. (US) 2015-03-03 — — US disclosed
US-20130123231-A1 ACC INHIBITORS AND USES THEREOF Nimbus Apollo, Inc. (US) 2013-05-16 — — US disclosed
WO-2013071169-A1 ACC INHIBITORS AND USES THEREOF Nimbus Apollo, Inc. (US) 2013-05-16 — — WO 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 (2 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-20130123231-A1 ACC INHIBITORS AND USES THEREOF ACACA, ACACB, ACAT2 AXL 3734/4885TYRO3 4576/4885MERTK 3625/4885
US-20160297834-A1 ACC INHIBITORS AND USES THEREOF ACACA, ACACB, ACAT2 AXL 3734/4885TYRO3 4576/4885MERTK 3625/4885

“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.

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