SCHEMBL19785977

SCHEMBL19785977

Cc1cc(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c(C)c(N=S)c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 5/20 0.37
RORC P51449 5/20 0.37
KCNH2 Q12809 2/20 0.37
GPR119 Q8TDV5 2/20 0.35
SETD7 Q8WTS6 1/20 0.35
MAP4K4 O95819 1/20 0.35
SPR P35270 2/20 0.34
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HDAC1 Q13547 1/20 0.34

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
SCHEMBL19785979 0.90 SETD7 (0.36) PTGDR2RORCKCNH2GPR119SETD7
SCHEMBL29613569 0.90 SETD7 (0.36) PTGDR2RORCKCNH2GPR119SETD7
SCHEMBL19785964 0.90 PTGDR2 (0.43) PTGDR2RORCSETD7SPR
SCHEMBL19785594 0.85 HDAC1 (0.41) PTGDR2RORCKCNH2GPR119SETD7
SCHEMBL29613577 0.85 HDAC1 (0.41) PTGDR2RORCKCNH2GPR119SETD7
SCHEMBL19785875 0.83 RORC (0.41) PTGDR2RORCKCNH2GPR119SETD7
SCHEMBL20614223 0.81 ALDH1A1 (0.44) PTGDR2RORCKCNH2GPR119SETD7
SCHEMBL21368973 0.81 PTGDR2 (0.42) PTGDR2RORCSETD7
SCHEMBL29613593 0.81 PTGDR2 (0.42) PTGDR2RORCSETD7
SCHEMBL28278664 0.79 PARP1 (0.37) LMNANPSR1

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-10934282-B2 Heteroaromatic modulators of the retinoid-related orphan receptor gamma LEO PHARMA A/S (DK) 2021-03-02 US disclosed
US-20200291010-A1 HETEROAROMATIC MDOULATORS OF THE RETINOID-RELATED ORPHAN RECEPTOR GAMMA LEO PHARMA A/S 2020-09-17 US disclosed
EP-3484880-B1 HETEROAROMATIC MODULATORS OF THE RETINOID-RELATED ORPHAN RECEPTOR GAMMA LEO PHARMA AS (DK) 2020-09-02 EP disclosed
WO-2018011201-A1 HETEROAROMATIC MODULATORS OF THE RETINOID-RELATED ORPHAN RECEPTOR GAMMA LEO PHARMA A/S (DK) 2018-01-18 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-20200291010-A1 HETEROAROMATIC MDOULATORS OF THE RETINOID-RELATED ORPHAN RECEPTOR GAMMA RXRA, RORA, NR1H3 PTGDR2 328/4885RORC 18/4885KCNH2 2774/4885
US-10934282-B2 Heteroaromatic modulators of the retinoid-related orphan receptor gamma RXRA, RXRG, RXRB PTGDR2 434/4885RORC 17/4885KCNH2 1887/4885

“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.