SCHEMBL14945678

SCHEMBL14945678

CCc1sc2c(c1C)c(=O)n(CCO)c(=O)n2Cc1ccc2ccn(C)c2c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TP53 P04637 3/20 0.41
ACACB O00763 1/20 0.41
ACACA Q13085 1/20 0.41
ADORA2B P29275 3/20 0.40
MAPT P10636 1/20 0.40
LMNA P02545 1/20 0.39
TRPC5 Q9UL62 1/20 0.36

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
SCHEMBL14945681 0.89 KMT2A (0.45) MEN1KMT2ATP53MAPTLMNA
SCHEMBL14945682 0.88 TP53 (0.39) MEN1KMT2ATP53ADORA2BMAPT
SCHEMBL14944989 0.85 MEN1 (0.70) MEN1KMT2ATP53ACACBACACA
SCHEMBL14945679 0.84 ADORA2B (0.39) MEN1KMT2ATP53ADORA2BMAPT
SCHEMBL14936764 0.75 KMT2A (0.59) MEN1KMT2ATP53ACACBACACA
SCHEMBL29453891 0.75 KMT2A (0.59) MEN1KMT2ATP53ACACBACACA
SCHEMBL14948750 0.74 MEN1 (0.56) MEN1KMT2ATP53ACACBACACA
SCHEMBL14948697 0.73 MEN1 (0.53) MEN1KMT2ATP53ACACBACACA
SCHEMBL20651076 0.70 MEN1 (0.55) MEN1KMT2ATP53ACACBACACA
SCHEMBL14936206 0.70 MEN1 (0.79) MEN1KMT2ATP53ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9944655-B2 ACC inhibitors and uses thereof GILEAD APOLLO, LLC (US) 2018-04-17 US disclosed
US-20160297834-A1 ACC INHIBITORS AND USES THEREOF GILEAD APOLLO, LLC 2016-10-13 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
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 (3 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 MEN1 4200/4885KMT2A 2071/4885TP53 3699/4885
US-20130123231-A1 ACC INHIBITORS AND USES THEREOF ACACA, ACACB, ACAT2 MEN1 4200/4885KMT2A 2071/4885TP53 3699/4885
US-20160297834-A1 ACC INHIBITORS AND USES THEREOF ACACA, ACACB, ACAT2 MEN1 4200/4885KMT2A 2071/4885TP53 3699/4885

“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.