SCHEMBL29918680

SCHEMBL29918680

CON(C)C(=O)c1cc(N)cc(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.49
GPBAR1 Q8TDU6 12/20 0.46
NOTUM Q6P988 1/20 0.41
TACR1 P25103 1/20 0.41
CES2 O00748 1/20 0.41
CFTR P13569 1/20 0.37

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
SCHEMBL3652937 0.89 MLYCD (0.55) MLYCDGPBAR1NOTUMTACR1CES2
SCHEMBL3050386 0.84 GPBAR1 (0.49) GPBAR1NOTUMTACR1CES2
SCHEMBL31048071 0.83 MLYCD (0.50) MLYCDGPBAR1NOTUMTACR1CES2
SCHEMBL12563345 0.83 MLYCD (0.50) MLYCDGPBAR1NOTUMTACR1CES2
SCHEMBL1662271 0.83 MLYCD (0.50) MLYCDGPBAR1NOTUMTACR1CES2
SCHEMBL12187536 0.83 MLYCD (0.50) MLYCDGPBAR1NOTUMTACR1CES2
SCHEMBL13715456 0.83 MLYCD (0.50) MLYCDGPBAR1NOTUMTACR1CES2
SCHEMBL4757590 0.82 MLYCD (0.49) MLYCDGPBAR1NOTUMTACR1CES2
SCHEMBL14355588 0.82 NOTUM (0.63) MLYCDGPBAR1NOTUMTACR1CES2
SCHEMBL1189827 0.82 MLYCD (0.49) MLYCDGPBAR1NOTUMTACR1CES2

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-20220324862-A1 PYRIDOPYRIMIDINONE COMPOUNDS ACERAND THERAPEUTICS (USA) LIMITED 2022-10-13 US disclosed
WO-2022212531-A1 PYRIDOPYRIMIDINONE COMPOUNDS ACERAND THERAPEUTICS (USA) LIMITED (US) 2022-10-06 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 (1 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-20220324862-A1 PYRIDOPYRIMIDINONE COMPOUNDS RSU1, SOST, CCNA1 MLYCD 4685/4885GPBAR1 1810/4885NOTUM 4854/4885

“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.