SCHEMBL4183822

SCHEMBL4183822

COC(=O)N(C(Cc1ccc(F)c(F)c1)C(=O)O)C1c2ccccc2-c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIN1 Q13526 1/20 0.36
▸ CTSD P07339 3/20 0.35
▸ IDO1 P14902 1/20 0.35
▸ LDHA P00338 1/20 0.34
▸ CYP2D6 P10635 2/20 0.34
▸ DRD2 P14416 2/20 0.34
▸ DRD4 P21917 2/20 0.34
▸ SSTR1 P30872 2/20 0.34
▸ SSTR2 P30874 2/20 0.34
▸ SSTR4 P31391 2/20 0.34
▸ SSTR3 P32745 2/20 0.34
▸ MMP1 P03956 1/20 0.34
▸ ITGB1 P05556 1/20 0.34
▸ ITGA4 P13612 1/20 0.34
▸ PPARG P37231 1/20 0.33
▸ PPARA Q07869 1/20 0.33
▸ PSEN1 P49768 1/20 0.33
▸ PSEN2 P49810 1/20 0.33
▸ APH1B Q8WW43 1/20 0.33
▸ NCSTN Q92542 1/20 0.33

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
SCHEMBL25185914 0.88 ITGB1 (0.39) PIN1CYP2D6ITGB1ITGA4PPARG
SCHEMBL30510333 0.87 LDHA (0.37) LDHAMMP1PPARGPPARA
SCHEMBL25186573 0.87 SLC1A1 (0.41) CYP2D6PPARGPPARA
SCHEMBL30510391 0.87 PSEN1 (0.38) PIN1PSEN1PSEN2APH1BNCSTN
SCHEMBL30510366 0.86 CTRB1 (0.40) ITGB1ITGA4PPARGPPARA
SCHEMBL4600752 0.86 CTRB1 (0.40) ITGB1ITGA4PPARGPPARA
SCHEMBL4600067 0.86 CTRB1 (0.40) ITGB1ITGA4PPARGPPARA
SCHEMBL5407004 0.86 CTRB1 (0.40) ITGB1ITGA4PPARGPPARA
SCHEMBL1405759 0.86 LDHA (0.51) LDHAMMP1
SCHEMBL4034320 0.86 PPARG (0.41) PIN1MMP1PPARGPPARAMME

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-20090215783-A1 COMPOSITION FOR INDUCTION OR INHIBITION OF STEM CELL DIFFERENTIATION CHOONGWAE PHARMA CORPORATION (KR) 2009-08-27 — — US disclosed
EP-2029142-A1 COMPOSITION FOR INDUCTION OR INHIBITION OF STEM CELL DIFFERENTIATION Choongwae Pharma Corporation (KR) 2009-03-04 — — EP disclosed
WO-2007139346-A1 COMPOSITION FOR INDUCTION OR INHIBITION OF STEM CELL DIFFERENTIATION CHOONGWAE PHARMA CORPORATION (KR) 2007-12-06 — — WO 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-20090215783-A1 COMPOSITION FOR INDUCTION OR INHIBITION OF STEM CELL DIFFERENTIATION MYLK2, TNNC1, MYH2 PIN1 1552/4885CTSD 742/4885IDO1 988/4885

“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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