SCHEMBL4334586

SCHEMBL4334586

CC(C)OC(Cc1ccccc1COC(=O)Nc1ccc(F)cc1F)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.46
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
RECQL P46063 1/20 0.42
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
HTT P42858 1/20 0.41
POLB P06746 3/20 0.41
F9 P00740 1/20 0.40
F10 P00742 1/20 0.40
PLAU P00749 1/20 0.40
P2RY1 P47900 1/20 0.40
CASP3 P42574 1/20 0.39
TACR1 P25103 1/20 0.39
EGFR P00533 1/20 0.38
PPIA P62937 1/20 0.38

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
SCHEMBL4334583 0.85 PPARG (0.43) PKMALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL4335538 0.85 KMT2A (0.45) ALDH1A1SMN1; SMN2RAB9ANPC1HTT
SCHEMBL4340671 0.82 OPRK1 (0.44) ALDH1A1SMN1; SMN2RAB9ANPC1HTT
SCHEMBL4347051 0.81 POLB (0.41) PKMRECQLPOLBP2RY1PPIA
SCHEMBL4329791 0.81 LMNA (0.44) ALDH1A1SMN1; SMN2RECQLRAB9ANPC1
SCHEMBL6727260 0.80 NPC1 (0.47) ALDH1A1SMN1; SMN2RAB9ANPC1HTT
SCHEMBL4341327 0.79 ALOX15 (0.38) PKMALDH1A1SMN1; SMN2NPC1F9
SCHEMBL6724483 0.78 MTNR1B (0.48) PKMSMN1; SMN2RECQLRAB9ANPC1
SCHEMBL4341658 0.78 MAPT (0.48) ALDH1A1SMN1; SMN2RAB9ANPC1HTT
SCHEMBL4327192 0.77 CYP1A2 (0.56) ALDH1A1SMN1; SMN2RAB9ANPC1POLB

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-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-20040102634-A1 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-05-27 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-20040102634-A1 Carboxylic acid derivative and salt thereof GPR119, IRS1, SLC5A1 PKM 4339/4885ALDH1A1 844/4885SMN1; SMN2 3054/4885

“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.