SCHEMBL5465537

SCHEMBL5465537

O=C(Nc1nccc(-c2cccc(C(F)(F)F)c2)n1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 1/20 0.61
▸ ABL1 P00519 2/20 0.54
▸ BCR P11274 2/20 0.54
▸ PRKD3 O94806 1/20 0.54
▸ PRKCG P05129 1/20 0.54
▸ PRKCB P05771 1/20 0.54
▸ PDGFRB P09619 1/20 0.54
▸ SRC P12931 1/20 0.54
▸ PDGFRA P16234 1/20 0.54
▸ PRKCA P17252 1/20 0.54
▸ PRKCH P24723 1/20 0.54
▸ PRKCI P41743 1/20 0.54
▸ PRKCE Q02156 1/20 0.54
▸ PRKCQ Q04759 1/20 0.54
▸ PRKCZ Q05513 1/20 0.54
▸ PRKCD Q05655 1/20 0.54
▸ PRKD1 Q15139 1/20 0.54
▸ AURKA O14965 1/20 0.54
▸ ADORA1 P30542 1/20 0.53
▸ MAPT P10636 1/20 0.53

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
SCHEMBL5470852 0.84 ADORA1 (0.69) ABL1BCRPRKD3PRKCGPRKCB
SCHEMBL5464069 0.82 ALDH1A1 (0.61) KMOABL1PDGFRBSRCPDGFRA
SCHEMBL5462697 0.82 ALDH1A1 (0.58) ABL1BCRPRKD3PRKCGPRKCB
SCHEMBL5467412 0.81 KMO (0.56) KMOADORA1MAPTLMNA
SCHEMBL11468072 0.80 KMO (0.58) KMOAURKAMAPK14ALDH1A1MAPK13
SCHEMBL4900014 0.79 KMO (0.72) KMOABL1BCRPRKCAAURKA
SCHEMBL5465350 0.79 SIRT2 (0.68) ABL1BCRPRKD3PRKCGPRKCB
SCHEMBL5466956 0.79 JAK2 (0.72) ABL1BCRPRKD3PRKCGPRKCB
SCHEMBL5465315 0.78 PLK1 (0.61) ABL1BCRPRKD3PRKCGPRKCB
SCHEMBL5472823 0.78 ADORA1 (0.57) ABL1BCRPRKD3PRKCGPRKCB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070099938-A1 Antistress drug and medical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-05-03 — — US disclosed
EP-1679309-A1 ANTISTRESS DRUG AND MEDICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 — — EP 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-20070099938-A1 Antistress drug and medical use thereof NPSR1, MC2R, SRR KMO 1813/4885ABL1 1671/4885BCR 1148/4885

“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.

Send feedback