SCHEMBL178818

SCHEMBL178818

COc1ccc(-c2cc(C)c3[nH]c4cc(OC)ccc4c3n2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.65
DYRK1A Q13627 5/20 0.51
ALDH1A1 P00352 4/20 0.49
HPGD P15428 3/20 0.49
LMNA P02545 1/20 0.49
KDM4E B2RXH2 4/20 0.48
DYRK3 O43781 1/20 0.48
CCNT1 O60563 1/20 0.48
CCNB2 O95067 1/20 0.48
CYP1A2 P05177 1/20 0.48
CDK1 P06493 1/20 0.48
CYP3A4 P08684 1/20 0.48
ADRA2A P08913 1/20 0.48
CYP2D6 P10635 1/20 0.48
CCNB1 P14635 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48
CCNA2 P20248 1/20 0.48
MAOA P21397 1/20 0.48
ACHE P22303 1/20 0.48

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
SCHEMBL178819 0.83 JAK2 (0.47) JAK2DYRK1AALDH1A1HPGDLMNA
SCHEMBL142655 0.82 JAK2 (0.78) JAK2DYRK1AALDH1A1HPGDLMNA
SCHEMBL178707 0.81 JAK2 (0.69) JAK2DYRK1AALDH1A1HPGDLMNA
SCHEMBL141522 0.81 JAK2 (0.80) JAK2DYRK1AALDH1A1HPGDLMNA
SCHEMBL142463 0.81 JAK2 (0.77) JAK2DYRK1ACLK1CDK5CDK5R1
SCHEMBL178661 0.79 JAK2 (0.67) JAK2DYRK1AALDH1A1HPGDLMNA
SCHEMBL143862 0.79 JAK2 (1.00) JAK2DYRK1AALDH1A1HPGDLMNA
SCHEMBL30940003 0.75 DYRK1A (0.63) DYRK1AALDH1A1HPGDLMNAKDM4E
SCHEMBL16126072 0.75 DYRK1A (0.63) DYRK1AALDH1A1HPGDLMNAKDM4E
SCHEMBL141989 0.73 JAK2 (0.68) JAK2

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-20120058988-A1 CARBAZOLE AND CARBOLINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-03-08 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-20120058988-A1 CARBAZOLE AND CARBOLINE KINASE INHIBITORS JAK2, JAK1, JAK3 JAK2 1/4885DYRK1A 317/4885ALDH1A1 1464/4885

“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.