SCHEMBL12528466

SCHEMBL12528466

CCn1nc(C)cc1-c1nc2c(C)cc(C)cc2c(=O)o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ PARP1 P09874 1/20 0.36
▸ ADORA2B P29275 1/20 0.35
▸ KDM4E B2RXH2 4/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ POLB P06746 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ PTK2B Q14289 1/20 0.33
▸ HPGD P15428 2/20 0.33
▸ KRAS P01116 1/20 0.32
▸ PIK3CD O00329 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ PIK3CB P42338 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ ELANE P08246 2/20 0.32
▸ F2 P00734 1/20 0.31
▸ TP53 P04637 1/20 0.31

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
SCHEMBL12912004 0.85 HTT (0.35) SMN1; SMN2PARP1KDM4EALDH1A1ELANE
SCHEMBL12528517 0.81 SMN1; SMN2 (0.36) SMN1; SMN2RAB9APARP1KDM4EALDH1A1
SCHEMBL12528498 0.81 SMN1; SMN2 (0.36) SMN1; SMN2RAB9APARP1KDM4EALDH1A1
SCHEMBL12528684 0.79 PDE5A (0.34) PARP1PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL12528298 0.78 RAB9A (0.46) SMN1; SMN2RAB9AKDM4EALDH1A1POLB
SCHEMBL12528609 0.76 ALDH1A1 (0.36) SMN1; SMN2RAB9APARP1KDM4EALDH1A1
SCHEMBL12528272 0.74 SMN1; SMN2 (0.39) SMN1; SMN2RAB9AKDM4EALDH1A1POLB
SCHEMBL12747248 0.74 SMN1; SMN2 (0.37) SMN1; SMN2RAB9AKDM4EALDH1A1KMT2A
SCHEMBL951344 0.74 STIM1 (0.34) ELANE
SCHEMBL22952937 0.73 NPC1 (0.51) SMN1; SMN2RAB9APARP1KDM4EALDH1A1

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-7968573-B2 Hydrazide compound and pesticidal use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-28 — — US disclosed
US-20110071291-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME IKEGAMI HIROSHI 2011-03-24 — — 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-20110071291-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME ACHE, H1-2, H1-0 S1PR1 2415/4885SMN1; SMN2 2851/4885RAB9A 391/4885

“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.

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