SCHEMBL267560

SCHEMBL267560

CCc1c(C=O)ccc(F)c1CCl

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 2/20 0.35
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MEN1 O00255 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL6851211 0.80 TDP1 (0.41) TDP1ALDH1A1L3MBTL1MEN1HTT
SCHEMBL28127127 0.79 ERN1 (0.38) ERN1TDP1ALDH1A1L3MBTL1MEN1
SCHEMBL31421938 0.76 ERN1 (0.36) ERN1TDP1ALDH1A1L3MBTL1
SCHEMBL269869 0.76 ERN1 (0.36) ERN1TDP1ALDH1A1MEN1HTT
SCHEMBL7184430 0.76 ERN1 (0.52) ERN1TDP1ALDH1A1MEN1HTT
SCHEMBL1561409 0.73 TAAR1 (0.36) L3MBTL1
SCHEMBL5490363 0.72 SRC (0.35) TDP1ALDH1A1L3MBTL1MEN1HTT
SCHEMBL28259498 0.71 ALDH1A1 (0.41) ERN1TDP1ALDH1A1L3MBTL1MEN1
SCHEMBL954206 0.71 CYP2C9 (0.44) ERN1ALDH1A1MEN1KMT2A
SCHEMBL3338705 0.70 TDP1 (0.36) ERN1TDP1ALDH1A1L3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-05-10 US disclosed
US-8134015-B2 Compound inhibiting in vivo phosphorous transport and medicine containing the same KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-03-13 US disclosed
US-20060217426-A1 Compound inhibiting in vivo phosphorous transport and medicine containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-09-28 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 (2 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-20060217426-A1 Compound inhibiting in vivo phosphorous transport and medicine containing the same SLC10A6, SLC7A1, SLC10A1 ERN1 3405/4885TDP1 4744/4885ALDH1A1 3022/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 ERN1 3472/4885TDP1 4604/4885ALDH1A1 2872/4885

“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.