SCHEMBL3425344

SCHEMBL3425344

Ic1cccc2c(-c3c(P(c4ccccc4)c4ccccc4)ccc4c(I)cccc34)c(P(c3ccccc3)c3ccccc3)ccc12

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ DRD1 P21728 2/20 0.33
▸ ESR1 P03372 2/20 0.31
▸ ESR2 Q92731 2/20 0.31
▸ DYRK1A Q13627 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
SCHEMBL19010020 0.81 CYP3A4 (0.41) CYP3A4TDP1DRD1ESR1ESR2
SCHEMBL14596146 0.80 CYP3A4 (0.39) CYP3A4TDP1DRD1ESR1ESR2
SCHEMBL3940105 0.79 ALDH1A1 (0.46) CYP3A4TDP1DRD1
SCHEMBL14596133 0.75 CA1 (0.38) CYP3A4TDP1DRD1
SCHEMBL5425957 0.75 LOXL2 (0.35) CYP3A4TDP1DRD1
SCHEMBL19010003 0.73 CYP3A4 (0.33) CYP3A4TDP1
SCHEMBL146878 0.73 ALDH1A1 (0.44) CYP3A4TDP1ESR1ESR2
SCHEMBL5107 0.73 ALDH1A1 (0.44) CYP3A4TDP1ESR1ESR2
SCHEMBL29350037 0.73 ALDH1A1 (0.44) CYP3A4TDP1ESR1ESR2
SCHEMBL29496111 0.73 ALDH1A1 (0.44) CYP3A4TDP1ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9006484-B2 Polymer having bis(diphenylphosphino)binaphthyl groups KYOEISHA CHEMICAL CO., LTD. (JP) 2015-04-14 — — US claimed
US-20100022800-A1 POLYMER HAVING BIS(DIPHENYLPHOSPHINO)BINAPHTHYL GROUPS KYOEISHA CHEMICAL CO., LTD. (JP) 2010-01-28 — — US claimed
EP-2050776-A1 POLYMER HAVING BIS(DIPHENYLPHOSPHINO)BINAPHTHYL GROUP Kyoeisha Chemical Co., Ltd. (JP) 2009-04-22 — — EP claimed
US-9006484-B2 Polymer having bis(diphenylphosphino)binaphthyl groups KYOEISHA CHEMICAL CO., LTD. (JP) 2015-04-14 — — US disclosed
US-20100022800-A1 POLYMER HAVING BIS(DIPHENYLPHOSPHINO)BINAPHTHYL GROUPS KYOEISHA CHEMICAL CO., LTD. (JP) 2010-01-28 — — US disclosed
EP-2050776-A1 POLYMER HAVING BIS(DIPHENYLPHOSPHINO)BINAPHTHYL GROUP Kyoeisha Chemical Co., Ltd. (JP) 2009-04-22 — — EP 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-20100022800-A1 POLYMER HAVING BIS(DIPHENYLPHOSPHINO)BINAPHTHYL GROUPS PCBP1, PARG, PHOSPHO1 CYP3A4 2575/4885TDP1 2600/4885DRD1 1304/4885

“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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