SCHEMBL4205361

SCHEMBL4205361

Cc1ccc(NC(=O)c2cc[nH]n2)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.56
NPC1 O15118 3/20 0.51
POLB P06746 3/20 0.49
ALOX15 P16050 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
TDP1 Q9NUW8 1/20 0.46
TP53 P04637 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
MAPT P10636 2/20 0.46
HTT P42858 2/20 0.46
ALDH1A1 P00352 2/20 0.46
TAS1R3 Q7RTX0 2/20 0.45
TAS1R1 Q7RTX1 2/20 0.45
TAS1R2 Q8TE23 2/20 0.45

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
SCHEMBL4187732 0.87 KMT2A (0.54) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL4198230 0.85 ALOX15 (0.63) RAB9ANPC1POLBALOX15CYP1A2
SCHEMBL4186735 0.83 ALOX15 (0.65) ALOX15CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL4188965 0.82 MEN1 (0.45) POLBALOX15CYP1A2CYP3A4CYP2C9
SCHEMBL4199011 0.80 NPC1 (0.53) RAB9ANPC1POLBALOX15CYP1A2
SCHEMBL18027798 0.77 RAB9A (0.54) RAB9ANPC1POLBCYP1A2CYP3A4
SCHEMBL16140721 0.77 RAB9A (0.68) RAB9ANPC1POLBCYP1A2CYP2C19
SCHEMBL4195751 0.77 MEN1 (0.53) RAB9APOLBALOX15CYP1A2CYP3A4
SCHEMBL169574 0.76 ALOX15 (0.47) RAB9AALOX15CYP1A2CYP2C19SMN1; SMN2
SCHEMBL13321368 0.75 NPC1 (0.64) RAB9ANPC1SMN1; SMN2TP53RXFP1

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-20090088463-A1 Pyrazoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-04-02 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-20090088463-A1 Pyrazoles Useful in the Treatment of Inflammation ALOX15, ALOX5, ALOX15B RAB9A 3897/4885NPC1 2317/4885POLB 2613/4885

“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.