SCHEMBL19785897

SCHEMBL19785897

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

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MLNR O43193 10/20 0.35
XIAP P98170 3/20 0.33
BIRC2 Q13490 2/20 0.33
GRM2 Q14416 2/20 0.33
PARP1 P09874 1/20 0.33
PARP2 Q9UGN5 1/20 0.33
CHRM3 P20309 3/20 0.32
PDE10A Q9Y233 1/20 0.32

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
Hydrochloric Acid SCHEMBL21354336 0.99 MLNR (0.34) MLNRXIAPBIRC2GRM2PARP1
SCHEMBL28279934 0.87 MLNR (0.37) MLNR
SCHEMBL19785978 0.83 BIRC2 (0.38) MLNRXIAPBIRC2GRM2CHRM3
SCHEMBL19785899 0.83 LMNA (0.42)
Hydrochloric Acid SCHEMBL21354312 0.82 BIRC2 (0.37) MLNRXIAPBIRC2GRM2CHRM3
SCHEMBL19785775 0.81 XIAP (0.39) MLNRXIAPBIRC2CHRM3PDE10A
Hydrochloric Acid SCHEMBL21354281 0.80 XIAP (0.39) MLNRXIAPBIRC2CHRM3PDE10A
SCHEMBL21354323 0.76 RORC (0.41)
SCHEMBL19785893 0.72 RORC (0.36)
SCHEMBL19785608 0.72 RORC (0.51)

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 6 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
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 MLNR 996/4885XIAP 4531/4885BIRC2 4008/4885
US-10934282-B2 Heteroaromatic modulators of the retinoid-related orphan receptor gamma RXRA, RXRG, RXRB MLNR 631/4885XIAP 4037/4885BIRC2 3917/4885
US-10662181-B2 Heteroaromatic modulators of the retinoid-related orphan receptor gamma RXRA, RXRG, RXRB MLNR 631/4885XIAP 4037/4885BIRC2 3917/4885
US-20190284177-A1 HETEROAROMATIC MODULATORS OF THE RETINOID-RELATED ORPHAN RECEPTOR GAMMA RXRA, RXRG, RXRB MLNR 631/4885XIAP 4037/4885BIRC2 3917/4885

“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.