SCHEMBL6842202

SCHEMBL6842202

CC(=O)c1cc(-c2ccccn2)sc1N1CCOCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
NPSR1 Q6W5P4 4/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
LMNA P02545 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
BRD9 Q9H8M2 1/20 0.50
BAZ2B Q9UIF8 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
PIK3CA P42336 2/20 0.46
PIK3R1 P27986 1/20 0.46
MTOR P42345 1/20 0.46
AR P10275 1/20 0.44
SCN9A Q15858 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL6799182 0.80 JUN (0.48) ALDH1A1NPSR1PIK3CAPIK3R1AR
SCHEMBL18412843 0.73 ALDH1A1 (0.51) ALDH1A1NPSR1MEN1KMT2APIK3CA
SCHEMBL18412858 0.72 PRKDC (0.48) ALDH1A1NPSR1L3MBTL1LMNATDP1
SCHEMBL6804364 0.72 PRKDC (0.48) ALDH1A1NPSR1LMNAPIK3CAPIK3R1
SCHEMBL18412859 0.70 PRKDC (0.46) ALDH1A1NPSR1LMNAMEN1KMT2A
SCHEMBL18412857 0.70 ALDH1A1 (0.48) ALDH1A1NPSR1LMNAPIK3CAPIK3R1
SCHEMBL9374034 0.68 KDM4E (0.73) ALDH1A1L3MBTL1LMNAKMT2ACYP3A4
SCHEMBL18412862 0.68 PRKDC (0.44) ALDH1A1NPSR1LMNAMEN1KMT2A
SCHEMBL6798831 0.67 CDC7 (0.43) ALDH1A1MEN1KMT2ACYP2C9MAPT
SCHEMBL6803709 0.66 PLOD2 (0.42) ALDH1A1MEN1KMT2ACYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040142976-A1 Pyridylfuran and pyridylthiophene compounds PFIZER INC. 2004-07-22 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-20040142976-A1 Pyridylfuran and pyridylthiophene compounds MC2R, FCGR2A, OGFR ALDH1A1 789/4885NPSR1 179/4885L3MBTL1 3138/4885

“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.