SCHEMBL19785606

SCHEMBL19785606

Cc1c(N)cc(C(F)F)cc1CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)C1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.37
HDAC1 Q13547 1/20 0.36
RORC P51449 7/20 0.36
PTGDR2 Q9Y5Y4 4/20 0.36
KCNH2 Q12809 2/20 0.36
ENPP2 Q13822 1/20 0.34
GPR119 Q8TDV5 2/20 0.34
SETD7 Q8WTS6 1/20 0.34
DPP4 P27487 1/20 0.33

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
SCHEMBL29613571 1.00 MAP4K4 (0.37) MAP4K4HDAC1RORCPTGDR2KCNH2
SCHEMBL29613565 0.87 RORC (0.36) RORCPTGDR2KCNH2
SCHEMBL19785893 0.87 RORC (0.36) RORCPTGDR2KCNH2
SCHEMBL17192237 0.87 RORC (0.45) MAP4K4HDAC1RORCPTGDR2KCNH2
SCHEMBL18628088 0.87 RORC (0.45) MAP4K4HDAC1RORCPTGDR2KCNH2
SCHEMBL19785594 0.87 HDAC1 (0.41) MAP4K4HDAC1RORCPTGDR2KCNH2
SCHEMBL29613577 0.87 HDAC1 (0.41) MAP4K4HDAC1RORCPTGDR2KCNH2
SCHEMBL21354323 0.86 RORC (0.41) RORCPTGDR2KCNH2
SCHEMBL29613566 0.85 ALDH1A1 (0.43) RORCPTGDR2KCNH2ENPP2GPR119
SCHEMBL21368991 0.85 ALDH1A1 (0.43) RORCPTGDR2KCNH2ENPP2GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109476653-B Heteroaromatic modulators of retinoid-related orphan receptor gamma 利奥制药有限公司 2022-04-22 CN disclosed
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
US-10662181-B2 Heteroaromatic modulators of the retinoid-related orphan receptor gamma LEO PHARMA A/S (DK) 2020-05-26 US disclosed
US-20190284177-A1 HETEROAROMATIC MODULATORS OF THE RETINOID-RELATED ORPHAN RECEPTOR GAMMA LEO PHARMA A/S (DK) 2019-09-19 US 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 (4 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 MAP4K4 4600/4885HDAC1 2374/4885RORC 18/4885
US-10934282-B2 Heteroaromatic modulators of the retinoid-related orphan receptor gamma RXRA, RXRG, RXRB MAP4K4 4329/4885HDAC1 1397/4885RORC 17/4885
US-10662181-B2 Heteroaromatic modulators of the retinoid-related orphan receptor gamma RXRA, RXRG, RXRB MAP4K4 4329/4885HDAC1 1397/4885RORC 17/4885
US-20190284177-A1 HETEROAROMATIC MODULATORS OF THE RETINOID-RELATED ORPHAN RECEPTOR GAMMA RXRA, RXRG, RXRB MAP4K4 4329/4885HDAC1 1397/4885RORC 17/4885

“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.