SCHEMBL5255504

SCHEMBL5255504

COC(=O)c1cc2ccccc2nc1N

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 1/20 0.66
TLR8 Q9NR97 4/20 0.54
GALR3 O60755 1/20 0.51
NR2F2 P24468 1/20 0.51
ALDH1A1 P00352 6/20 0.50
KDM4E B2RXH2 6/20 0.50
HSD17B10 Q99714 2/20 0.50
CFTR P13569 1/20 0.50
HPGD P15428 4/20 0.48
MAPT P10636 2/20 0.48
ALOX15 P16050 2/20 0.48
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
ABCG2 Q9UNQ0 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL5193947 0.83 IKBKB (0.60) IKBKBTLR8GALR3NR2F2ALDH1A1
SCHEMBL28695443 0.83 IKBKB (0.64) IKBKBTLR8GALR3NR2F2ALDH1A1
SCHEMBL16234345 0.82 KDM4E (0.51) IKBKBALDH1A1KDM4EHPGDMAPT
SCHEMBL30201832 0.82 SMN1; SMN2 (0.60) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL68891 0.82 KDM4E (0.51) IKBKBALDH1A1KDM4EHPGDMAPT
SCHEMBL20098513 0.81 KDM4E (0.57) IKBKBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL6097776 0.81 ABCG2 (0.55) IKBKBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL6603045 0.81 KDM4E (0.51) IKBKBALDH1A1KDM4EHPGDMAPT
SCHEMBL31105839 0.81 KDM4E (0.57) IKBKBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL30972572 0.80 IKBKB (0.74) IKBKBTLR8GALR3NR2F2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170256721-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME INDUSTRY-ACADEMIC COOPERATION FOUNDATION GYEONGSANG NATIONAL UNIVERSITY (KR) 2017-09-07 US disclosed
US-20170256721-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME INDUSTRY-ACADEMIC COOPERATION FOUNDATION GYEONGSANG NATIONAL UNIVERSITY (KR) 2017-09-07 US disclosed
EP-1242382-B1 TRICYCLIC PROTEIN KINASE INHIBITORS WYETH CORP (US) 2007-02-07 EP disclosed
US-20060247217-A1 Tricyclic protein kinase inhibitors BERGER DAN M 2006-11-02 US disclosed
US-7105531-B2 Tricyclic protein kinase inhibitors WYETH (US) 2006-09-12 US disclosed
US-20040110762-A1 Tricyclic protein kinase inhibitors WYETH 2004-06-10 US disclosed
EP-1242382-A1 TRICYCLIC PROTEIN KINASE INHIBITORS Wyeth (US) 2002-09-25 EP disclosed
US-20010051620-A1 Tricyclic protein kinase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 2001-12-13 US disclosed
WO-2001047892-A1 TRICYCLIC PROTEIN KINASE INHIBITORS WYETH (US) 2001-07-05 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 (4 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-20040110762-A1 Tricyclic protein kinase inhibitors CDK1, CDKN1A, CDK2 IKBKB 593/4885TLR8 4613/4885GALR3 3847/4885
US-20170256721-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME C1R, C1S, CCNT1 IKBKB 3257/4885TLR8 3703/4885GALR3 487/4885
US-20060247217-A1 Tricyclic protein kinase inhibitors CDK1, CDKN1A, CDK2 IKBKB 607/4885TLR8 4677/4885GALR3 3818/4885
US-20010051620-A1 Tricyclic protein kinase inhibitors CDK1, CHEK1, ABL1 IKBKB 642/4885TLR8 4521/4885GALR3 3614/4885

“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.