SCHEMBL4178487

SCHEMBL4178487

O=C(Nc1ccc(NC(=O)c2cc[nH]n2)nc1)c1cc[nH]n1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.50
NPC1 O15118 9/20 0.50
SMN1; SMN2 Q16637 7/20 0.50
KMT2A Q03164 6/20 0.49
MEN1 O00255 3/20 0.49
KDM4E B2RXH2 3/20 0.49
MAPT P10636 4/20 0.48
CYP2C19 P33261 1/20 0.48
TP53 P04637 5/20 0.48
ALDH1A1 P00352 5/20 0.48
PKM P14618 2/20 0.48
HSD17B10 Q99714 2/20 0.48
LMNA P02545 1/20 0.48
MAPK1 P28482 1/20 0.48
P4HTM Q9NXG6 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
SCHEMBL4185825 0.87 GRM5 (0.53) KDM4E
SCHEMBL4192471 0.85 L3MBTL1 (0.58) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL23246095 0.85 KCNQ3 (0.57) RAB9ASMN1; SMN2
SCHEMBL23246009 0.84 KCNQ3 (0.52) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL4194916 0.84 PTGS1 (0.51) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL23246023 0.81 NPC1 (0.53) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL4178804 0.80 PTGS1 (0.58) RAB9ANPC1
SCHEMBL168618 0.80 MEN1 (0.63) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL1198985 0.77 NPC1 (0.58) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL16692723 0.76 KMT2A (0.44) RAB9ANPC1SMN1; SMN2KMT2AMEN1

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-20090143440-A1 Pyrazoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-06-04 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-20090143440-A1 Pyrazoles Useful in the Treatment of Inflammation ALOX15, ALOX12, ALOX15B RAB9A 3588/4885NPC1 2790/4885SMN1; SMN2 3819/4885

“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.