SCHEMBL6204655

SCHEMBL6204655

Cc1cc(N)c2cc(NC(=O)C=Cc3ccc(C(F)(F)F)cc3)ccc2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 18/20 1.00
APAF1 O14727 1/20 0.62
USP2 O75604 1/20 0.62
POLB P06746 1/20 0.62
MAPT P10636 1/20 0.62
MAPK1 P28482 1/20 0.62
UBE2N P61088 1/20 0.62
KMT2A Q03164 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62

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
SCHEMBL6204654 1.00 MCHR1 (1.00) MCHR1APAF1USP2POLBMAPT
SCHEMBL8359620 0.89 MCHR1 (0.80) MCHR1APAF1USP2POLBMAPT
SCHEMBL6204354 0.88 MCHR1 (1.00) MCHR1
SCHEMBL6204350 0.88 MCHR1 (1.00) MCHR1
SCHEMBL6198980 0.87 MCHR1 (1.00) MCHR1
SCHEMBL6199363 0.87 MCHR1 (1.00) MCHR1
SCHEMBL6198991 0.87 MCHR1 (1.00) MCHR1
SCHEMBL6199370 0.87 MCHR1 (1.00) MCHR1
SCHEMBL8356308 0.87 MCHR1 (0.77) MCHR1APAF1USP2POLBMAPT
SCHEMBL8356310 0.87 MCHR1 (0.77) MCHR1APAF1USP2POLBMAPT

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
EP-1451156-A4 4-AMINOQUINOLINE COMPOUNDS MERCK & CO INC (US) 2005-05-25 EP claimed
US-20050009815-A1 4-Aminoquinoline compounds DEVITA ROBERT J (US) 2005-01-13 US claimed
EP-1451156-A1 4-AMINOQUINOLINE COMPOUNDS Merck & Co., Inc. (US) 2004-09-01 EP claimed
WO-2003045920-A1 4-AMINOQUINOLINE COMPOUNDS MERCK & CO., INC. (US) 2003-06-05 WO claimed

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-20050009815-A1 4-Aminoquinoline compounds MCHR1, MCHR2, MC5R MCHR1 1/4885APAF1 3585/4885USP2 3964/4885

“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.