SCHEMBL4990771

SCHEMBL4990771

CCc1cc(Cl)nc(Cl)c1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.55
MAPK1 P28482 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
TAAR1 Q96RJ0 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 2/20 0.38
TSHR P16473 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
FABP4 P15090 2/20 0.38
FABP5 Q01469 2/20 0.38
FABP3 P05413 1/20 0.38
CYP2C19 P33261 1/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35

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
SCHEMBL2129323 0.84 ALDH1A1 (0.49) ALDH1A1MAPK1SMN1; SMN2TAAR1MEN1
SCHEMBL9704535 0.84 POLB (0.51) ALDH1A1MAPK1SMN1; SMN2TAAR1MEN1
SCHEMBL2129585 0.83 ALDH1A1 (0.49) ALDH1A1MAPK1SMN1; SMN2TAAR1MEN1
SCHEMBL473877 0.80 ALDH1A1 (0.74) ALDH1A1MAPK1SMN1; SMN2TAAR1MEN1
SCHEMBL29384281 0.80 ALDH1A1 (0.74) ALDH1A1MAPK1SMN1; SMN2TAAR1MEN1
SCHEMBL894222 0.76 ALDH1A1 (0.57) ALDH1A1MAPK1SMN1; SMN2TAAR1MEN1
SCHEMBL29982859 0.76 ALDH1A1 (0.57) ALDH1A1MAPK1SMN1; SMN2TAAR1MEN1
SCHEMBL9589529 0.75 SMN1; SMN2 (0.55) ALDH1A1MAPK1SMN1; SMN2TAAR1MEN1
SCHEMBL27691281 0.74 TDP1 (0.41) ALDH1A1MAPK1SMN1; SMN2MEN1KMT2A
SCHEMBL11001556 0.74 SMN1; SMN2 (0.34) ALDH1A1MAPK1SMN1; SMN2TAAR1MEN1

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-20080171732-A1 New Pyridine Analogues IX 519 ASTRAZENECA AB (SE) 2008-07-17 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-20080171732-A1 New Pyridine Analogues IX 519 P2RY12, P2RY11, P2RY1 ALDH1A1 1518/4885MAPK1 979/4885SMN1; SMN2 3568/4885

“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.