SCHEMBL16461497

SCHEMBL16461497

CON(C)C(=O)c1ccc2nc(C)c(Cc3ccccc3)c(C)c2c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 3/20 0.49
▸ RORC P51449 1/20 0.41
▸ HPGDS O60760 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ TLR8 Q9NR97 1/20 0.38
▸ GRM1 Q13255 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ IP6K1 Q92551 1/20 0.38
▸ IP6K3 Q96PC2 1/20 0.38
▸ IP6K2 Q9UHH9 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ TP53 P04637 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
SCHEMBL15648793 0.81 ALDH1A1 (0.62) PLA2G2AALDH1A1L3MBTL1HPGDLMNA
SCHEMBL12590494 0.74 ALDH1A1 (0.47) HPGDSALDH1A1HPGDLMNA
SCHEMBL18856332 0.74 RORC (0.43) PLA2G2ARORCALDH1A1L3MBTL1TLR8
SCHEMBL6489036 0.73 KMT2A (0.53) ALDH1A1L3MBTL1HPGDLMNA
SCHEMBL16462216 0.72 RORC (0.55) PLA2G2ARORCALDH1A1L3MBTL1TLR8
SCHEMBL18856329 0.72 PLA2G2A (0.48) PLA2G2ARORCALDH1A1TLR8GRM1
SCHEMBL28158605 0.71 RORC (0.45) PLA2G2ARORCALDH1A1TLR8HPGD
SCHEMBL6976721 0.70 CLK4 (0.43) ALDH1A1HPGDLMNA
SCHEMBL21574677 0.67 PKM (0.45) PLA2G2ARORCALDH1A1L3MBTL1POLB
SCHEMBL5604221 0.67 BRD4 (0.54) HPGD

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
EP-2909192-B1 METHYLENE LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T JANSSEN PHARMACEUTICA NV (BE) 2017-05-17 — — EP disclosed
US-9290476-B2 Methylene linked quinolinyl modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2016-03-22 — — US disclosed
US-9290476-B2 Methylene linked quinolinyl modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2016-03-22 — — US disclosed
US-9290476-B2 Methylene linked quinolinyl modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2016-03-22 — — US disclosed
US-20140107094-A1 METHYLENE LINKED QUINOLINYL MODULATORS OF RORyt JANSSEN PHARMACEUTICA NV (BE) 2014-04-17 — — US disclosed
US-20140107094-A1 METHYLENE LINKED QUINOLINYL MODULATORS OF RORyt JANSSEN PHARMACEUTICA NV (BE) 2014-04-17 — — US disclosed
US-20140107094-A1 METHYLENE LINKED QUINOLINYL MODULATORS OF RORyt JANSSEN PHARMACEUTICA NV (BE) 2014-04-17 — — 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 (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-20140107094-A1 METHYLENE LINKED QUINOLINYL MODULATORS OF RORyt RORC, RORA, RORB PLA2G2A 3685/4885RORC 1/4885HPGDS 1611/4885

“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.

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