SCHEMBL6405326

SCHEMBL6405326

CC1(C)CC(c2ccccc2NC(=O)Nc2ccc(F)cc2F)=NNC1=O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.48
RECQL P46063 1/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
HTT P42858 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
P2RY1 P47900 6/20 0.42
GAA P10253 1/20 0.42
POLB P06746 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL5569294 0.69 SMN1; SMN2 (0.53) PKMNPC1RAB9AHTTSMN1; SMN2
SCHEMBL27193044 0.69 RAB9A (0.77) PKMRECQLNPC1RAB9AHTT
SCHEMBL6406401 0.68 KDR (0.51) NPC1HTTMAPT
SCHEMBL2868835 0.66 P2RY1 (0.59) PKMRECQLNPC1RAB9AHTT
SCHEMBL17609477 0.65 RAB9A (1.00) PKMRECQLNPC1RAB9AHTT
SCHEMBL9037821 0.64 RAB9A (0.53) PKMRECQLNPC1RAB9AHTT
SCHEMBL11426554 0.63 RAB9A (0.63) PKMRECQLNPC1RAB9AHTT
SCHEMBL3163583 0.62 P2RY1 (0.74) PKMNPC1RAB9AHTTSMN1; SMN2
SCHEMBL1894047 0.62 RAB9A (0.66) PKMRECQLNPC1RAB9AHTT
SCHEMBL30664572 0.62 RAB9A (0.66) PKMRECQLNPC1RAB9AHTT

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-20050059658-A1 Pyridazinone BAYER AKTIENGESELLSCHAFT (DE) 2005-03-17 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-20050059658-A1 Pyridazinone TYMP, TPMT, PDXK PKM 634/4885RECQL 931/4885NPC1 3414/4885

“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.