SCHEMBL4094156

SCHEMBL4094156

CCOC(=O)c1cc2cc(-c3ccc(OC(C)C)cc3)sc2n1Cc1cccc(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.43
MAPT P10636 5/20 0.43
ALDH1A1 P00352 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
POLB P06746 1/20 0.43
TSHR P16473 1/20 0.43
ATM Q13315 1/20 0.43
KMT2A Q03164 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
P2RX3 P56373 2/20 0.42
NOD2 Q9HC29 1/20 0.42
NOD1 Q9Y239 1/20 0.42
TP53 P04637 3/20 0.41
F10 P00742 3/20 0.41
MEN1 O00255 2/20 0.41
HPGD P15428 2/20 0.41
LMNA P02545 1/20 0.41
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39

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
SCHEMBL4098695 0.89 CCR2 (0.51) PTGESP2RX3CCR2
SCHEMBL5738720 0.85 NOD2 (0.49) PTGESMAPTALDH1A1TDP1POLB
SCHEMBL4091859 0.81 KMT2A (0.47) MAPTALDH1A1TDP1POLBTSHR
SCHEMBL6782501 0.74 ABCB11 (0.58) MAPTALDH1A1TDP1POLBTSHR
SCHEMBL6307843 0.73 NOD2 (0.74) MAPTALDH1A1TDP1POLBTSHR
SCHEMBL5750477 0.73 CCR2 (0.62) PTGESCCR2
SCHEMBL4097358 0.72 CCR2 (0.44) PTGESMAPTP2RX3LMNACCR2
SCHEMBL4093394 0.71 CCR2 (0.55) HPGDLMNAKDM4ECCR2
SCHEMBL4099860 0.71 MAPT (0.56) MAPTALDH1A1TDP1POLBTSHR
SCHEMBL4086421 0.71 MAPT (0.48) PTGESMAPTALDH1A1TDP1POLB

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-20090069384-A1 THIENOPYRROLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2009-03-12 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-20090069384-A1 THIENOPYRROLES USEFUL IN THE TREATMENT OF INFLAMMATION NPY5R, TH, PTGES PTGES 3/4885MAPT 54/4885ALDH1A1 2718/4885

“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.