SCHEMBL23958623

SCHEMBL23958623

CC(C)(N)c1ccnc(-c2ccc(F)cc2)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.38
MAPK11 Q15759 6/20 0.38
MAPK13 O15264 4/20 0.38
MAPK12 P53778 4/20 0.38
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
RAF1 P04049 1/20 0.36
MAPK9 P45984 1/20 0.36
BCHE P06276 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CSNK1D P48730 4/20 0.35
BRAF P15056 1/20 0.35
CSNK1E P49674 2/20 0.34
TDO2 P48775 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
SCHEMBL30006965 1.00 MAPK14 (0.38) MAPK14MAPK11MAPK13MAPK12PDE3B
SCHEMBL30211293 0.84 MAPK14 (0.38) MAPK14MAPK11MAPK13MAPK12PDE3B
SCHEMBL23958624 0.76 PTGS2 (0.36) MAPK14PDE3BPDE3A
SCHEMBL30007231 0.71 BCHE (0.40) MAPK14MAPK11MAPK13MAPK12PDE3B
SCHEMBL25686895 0.71 BCHE (0.40) MAPK14MAPK11MAPK13MAPK12PDE3B
SCHEMBL31309443 0.71 ADORA2A (0.43) MAPK14KDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL25686618 0.69 AAK1 (0.38)
SCHEMBL23930180 0.68 ERBB2 (0.42) PDE3BPDE3ABCHEKDM4EALDH1A1
SCHEMBL26728885 0.68 BCHE (0.40) MAPK14MAPK11MAPK13MAPK12PDE3B
SCHEMBL16132361 0.67 KDM4E (0.46) MAPK14MAPK11MAPK13MAPK12BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203004-A1 RSV INHIBITING 3-SUBSTITUTED QUINOLINE AND CINNOLINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 US disclosed
CN-115461336-A RSV inhibiting 3-substituted quinoline and cinnoline derivatives 爱尔兰詹森科学公司 2022-12-09 CN disclosed
WO-2021214136-A1 RSV INHIBITING 3-SUBSTITUTED QUINOLINE AND CINNOLINE DERIVATIVES Janssen Sciences Ireland Unlimited Company (IE) 2021-10-28 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-20230203004-A1 RSV INHIBITING 3-SUBSTITUTED QUINOLINE AND CINNOLINE DERIVATIVES ACE2, SIRT7, ACE MAPK14 2142/4885MAPK11 2690/4885MAPK13 2515/4885

“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.