SCHEMBL17605083

SCHEMBL17605083

CC(=O)Nc1ccc2c(c1)CCC21NC(=O)N(CC(=O)OC(C)(C)C)C1=O

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 7/20 0.57
CREBBP Q92793 4/20 0.57
KMT2A Q03164 2/20 0.51
LMNA P02545 1/20 0.51
MEN1 O00255 1/20 0.51
MAPT P10636 1/20 0.51
ATAD2 Q6PL18 1/20 0.47
CYP2C19 P33261 1/20 0.46

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
SCHEMBL17605055 0.86 EP300 (0.64) EP300CREBBPKMT2ALMNAMEN1
SCHEMBL17606256 0.84 CYP2C19 (0.49) EP300KMT2ALMNAMEN1MAPT
SCHEMBL17604699 0.84 CYP2C19 (0.49) EP300CREBBPKMT2ALMNAMEN1
SCHEMBL17606326 0.83 CYP2C19 (0.66) EP300CREBBPKMT2ALMNAMEN1
SCHEMBL17605480 0.82 POLB (0.63) KMT2ALMNAMEN1MAPT
SCHEMBL17605478 0.82 POLB (0.63) KMT2ALMNAMEN1MAPT
SCHEMBL17606568 0.79 CYP2C19 (0.44) EP300CREBBPKMT2ALMNAMEN1
SCHEMBL17606404 0.79 CYP2C19 (0.44) KMT2ALMNAMEN1MAPTCYP2C19
SCHEMBL17604724 0.76 KMT2A (0.63) KMT2AMAPTCYP2C19
SCHEMBL17604779 0.74 EP300 (0.68) EP300CREBBP

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-20180193315-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC (US) 2018-07-12 US disclosed
US-20180071262-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC. (US) 2018-03-15 US disclosed
US-20160235716-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC. (US) 2016-08-18 US disclosed
WO-2016044770-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE ABBVIE INC. (US) 2016-03-24 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 (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-20160235716-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE KAT2B, HDAC1, HDAC9 EP300 5/4885CREBBP 154/4885KMT2A 127/4885
US-20180193315-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE KAT2B, HDAC1, KAT2A EP300 6/4885CREBBP 153/4885KMT2A 97/4885
US-20180071262-A1 SPIROCYCLIC HAT INHIBITORS AND METHODS FOR THEIR USE KAT2B, HDAC1, HDAC9 EP300 5/4885CREBBP 154/4885KMT2A 127/4885

“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.