SCHEMBL7018046

SCHEMBL7018046

Cn1nnc(-c2ccc(CCl)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
LMNA P02545 3/20 0.43
TSHR P16473 2/20 0.43
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MGLL Q99685 2/20 0.40
LTA4H P09960 1/20 0.40

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
SCHEMBL13846211 0.84 KMT2A (0.60) KMT2ARAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL646758 0.82 RAB9A (0.46) KMT2ARAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL16298846 0.82 HDAC6 (0.49) KMT2ARAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL7471122 0.82 SMN1; SMN2 (0.46) KMT2ARAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL19771902 0.81 KMT2A (0.47) KMT2ARAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL2611134 0.79 KMT2A (0.54) KMT2ARAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL19771915 0.79 SMN1; SMN2 (0.44) KMT2ARAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL18367843 0.79 SMN1; SMN2 (0.44) KMT2ARAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL10066462 0.79 LTA4H (0.48) KMT2ARAB9ANPC1SMN1; SMN2NFKB1
SCHEMBL27679605 0.79 RAB9A (0.44) KMT2ARAB9ANPC1SMN1; SMN2NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1537105-A Quinazolines useful as MMP-13 inhibitors ��������ʲ��������ι�˾ 2004-10-13 CN disclosed
EP-1368324-A1 QUINAZOLINES AS MMP-13 INHIBITORS Warner-Lambert Company LLC (US) 2003-12-10 EP disclosed
US-20020193377-A1 Quinazolines as MMP-13 inhibitors ANDRIANJARA CHARLES (FR) 2002-12-19 US disclosed
WO-2002064572-A1 QUINAZOLINES AS MMP-13 INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO 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-20020193377-A1 Quinazolines as MMP-13 inhibitors MMP13, MMP9, MMP3 KMT2A 3258/4885RAB9A 1888/4885NPC1 3752/4885

“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.