SCHEMBL13990430

SCHEMBL13990430

O=C(O)c1cccc2c1oc1c(C(=O)O)ccc(Nc3ccccc3F)c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25B P30305 5/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ MAPK8 P45983 1/20 0.41
▸ CXCL8 P10145 1/20 0.41
▸ PTGS2 P35354 2/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ C1R P00736 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ TUBB4A P04350 1/20 0.39
▸ TUBB P07437 1/20 0.39
▸ TUBA3C P0DPH7 1/20 0.39
▸ TUBA1B P68363 1/20 0.39
▸ TUBA4A P68366 1/20 0.39
▸ TUBB4B P68371 1/20 0.39
▸ TUBB3 Q13509 1/20 0.39
▸ TUBB2A Q13885 1/20 0.39

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
SCHEMBL13990419 0.84 TAS2R14 (0.51) CDC25BKDM4EALDH1A1GRIK1FABP4
SCHEMBL3832897 0.84 FABP4 (0.49) CDC25BKDM4EPTGS2ALDH1A1MAPT
SCHEMBL13990420 0.81 MPO (0.39) CDC25BMAPK8PTGS2ALDH1A1MAPT
SCHEMBL13990436 0.80 FABP3 (0.45) PTGS2ALDH1A1MAPTGRIK1FABP4
SCHEMBL13990427 0.79 AKR1C3 (0.46) CDC25BKDM4EALDH1A1MAPTFABP4
SCHEMBL13990424 0.78 ALDH1A1 (0.46) KDM4EPTGS2NPC1RAB9AALDH1A1
SCHEMBL13990448 0.78 GPR35 (0.46) KDM4ENPC1RAB9AALDH1A1C1R
SCHEMBL13990428 0.78 AKR1C3 (0.47) CDC25BAKR1B10AKR1B1AKR1C3AKR1C2
SCHEMBL3834341 0.77 MAPT (0.52) CDC25BKDM4EMAPTFABP4MEN1
SCHEMBL13990425 0.77 AKR1C3 (0.56) CDC25BMEN1KMT2AAKR1B10AKR1B1

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-20080319175-A1 Transthyretin Stabilization THE SCRIPPS RESEARCH INSTITUTE (US) 2008-12-25 — — US disclosed
US-20080319175-A1 Transthyretin Stabilization THE SCRIPPS RESEARCH INSTITUTE (US) 2008-12-25 — — 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-20080319175-A1 Transthyretin Stabilization TTR, TTPA, ALB CDC25B 3167/4885KDM4E 3239/4885MAPK8 4357/4885

“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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