SCHEMBL20993458

SCHEMBL20993458

CNC1(CN(C)C(=O)OC(C)(C)C)CC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FPR3 P25089 1/20 0.33
FPR2 P25090 1/20 0.33
ASGR1 P07306 1/20 0.32
CA14 Q9ULX7 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL31703654 0.77 HDAC6 (0.33) FPR3FPR2ASGR1CA14HDAC1
SCHEMBL16337389 0.75 CYP4F2 (0.37) FPR3FPR2ASGR1CA14HDAC1
SCHEMBL4137259 0.75 PDK2 (0.32) FPR3FPR2ASGR1HDAC1HDAC2
SCHEMBL15116573 0.75 CYP4F2 (0.33) FPR3FPR2ASGR1HDAC1HDAC2
SCHEMBL23282418 0.75 ASGR1 (0.40) FPR3FPR2ASGR1HDAC1HDAC2
SCHEMBL23713791 0.74 P2RX7 (0.30)
SCHEMBL22113052 0.73 ASGR1 (0.32) FPR3FPR2ASGR1HDAC1HDAC2
SCHEMBL20054494 0.73 FPR3 (0.33) FPR3FPR2ASGR1HDAC1HDAC2
SCHEMBL15144523 0.72 HDAC6 (0.37) ASGR1CA14HDAC1HDAC2HDAC6
SCHEMBL25319106 0.72 CTSL (0.36) FPR3FPR2ASGR1HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10961252-B2 Quinazoline and indole compounds to treat medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2021-03-30 US disclosed
US-20190135825-A1 Quinazoline and Indole Compounds to Treat Medical Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2019-05-09 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 (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-10961252-B2 Quinazoline and indole compounds to treat medical disorders CFB, TFPI, MAOB FPR3 179/4885FPR2 168/4885ASGR1 2154/4885
US-20190135825-A1 Quinazoline and Indole Compounds to Treat Medical Disorders CFB, TFPI, MAOB FPR3 179/4885FPR2 168/4885ASGR1 2154/4885

“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.