SCHEMBL3020709

SCHEMBL3020709

CN1CCN(c2ccc(-c3ccc4ncc(-c5ccnc(-c6ccoc6)c5)n4c3)cn2)CC1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FYN P06241 10/20 0.55
ALDH1A1 P00352 2/20 0.50
CYP1A2 P05177 2/20 0.50
ALOX15 P16050 2/20 0.50
HSD17B10 Q99714 2/20 0.50
FLT3 P36888 1/20 0.45
ACVR1B P36896 1/20 0.44
TGFBR1 P36897 1/20 0.44
MKNK1 Q9BUB5 1/20 0.44
MKNK2 Q9HBH9 1/20 0.44
CYP2D6 P10635 1/20 0.43
HDAC3 O15379 1/20 0.42
HDAC2 Q92769 1/20 0.42
CDK4 P11802 1/20 0.40
CCND1 P24385 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
SCHEMBL3029657 0.90 MKNK1 (0.44) FYNALDH1A1CYP1A2HSD17B10FLT3
SCHEMBL3022103 0.83 MKNK1 (0.50) FYNFLT3MKNK1MKNK2
SCHEMBL3035770 0.81 FLT3 (0.66) FYNFLT3MKNK1MKNK2
SCHEMBL3022710 0.77 PIK3CA (0.51) FYNFLT3MKNK1MKNK2
SCHEMBL3027184 0.77 FYN (0.48) FYNFLT3MKNK1MKNK2
SCHEMBL3028730 0.76 FYN (0.61) FYNFLT3ACVR1BTGFBR1
SCHEMBL3020669 0.74 FYN (0.46) FYNFLT3MKNK1MKNK2
SCHEMBL3028213 0.74 MKNK1 (0.50) FYNALDH1A1CYP1A2HSD17B10FLT3
SCHEMBL3035727 0.74 MKNK1 (0.56) FYNFLT3MKNK1MKNK2
SCHEMBL3022544 0.74 FYN (0.55) FYNFLT3MKNK1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8367662-B2 Organic compounds NOVARTIS AG (CH) 2013-02-05 US disclosed
EP-2212323-B1 IMIDAZO [1,2-A] PYRIDINE DERIVATIVES USEFUL AS ALK INHIBITORS NOVARTIS AG (CH) 2012-08-15 EP disclosed
US-20100210641-A1 Organic Compounds NOVARTIS AG (CH) 2010-08-19 US disclosed
EP-2212323-A2 IMIDAZO [1,2-A] PYRIDINE DERIVATIVES USEFUL AS ALK INHIBITORS Novartis AG (CH) 2010-08-04 EP disclosed
WO-2009050183-A2 IMIDAZO [1, 2-A] PYRIDINE DERIVATIVES USEFUL AS ALK INHIBITORS NOVARTIS AG (CH) 2009-04-23 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-20100210641-A1 Organic Compounds ALK, ACVR1, ACVRL1 FYN 1939/4885ALDH1A1 1069/4885CYP1A2 1051/4885

“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.