SCHEMBL3344635

SCHEMBL3344635

B.OCCCCCc1ccccc1P

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 1/20 0.39
▸ MGLL Q99685 1/20 0.35
▸ BCHE P06276 1/20 0.34
▸ BID P55957 1/20 0.33
▸ BCL2L1 Q07817 1/20 0.33
▸ MCL1 Q07820 1/20 0.33
▸ BAK1 Q16611 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ KCNH3 Q9ULD8 1/20 0.33
▸ CYSLTR2 Q9NS75 2/20 0.33
▸ CYSLTR1 Q9Y271 2/20 0.33
▸ TBXAS1 P24557 2/20 0.33
▸ CYP4F2 P78329 1/20 0.33
▸ CYP4A11 Q02928 1/20 0.33
▸ TAAR1 Q96RJ0 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL5141233 0.98 LIPG (0.40) LIPGMGLLBCHEBIDBCL2L1
SCHEMBL2178352 0.83 LIPG (0.47) LIPGMGLLBCHEBIDBCL2L1
SCHEMBL30750761 0.80 LIPG (0.43) LIPGMGLLBCHEBIDBCL2L1
SCHEMBL9672220 0.80 LIPG (0.43) LIPGMGLLBCHEBIDBCL2L1
Bromide SCHEMBL8416875 0.79 TDP1 (0.42) CA2TAAR1TDP1
SCHEMBL18660547 0.78 LIPG (0.58) LIPGBIDBCL2L1MCL1BAK1
SCHEMBL338793 0.78 LIPG (0.58) LIPGBIDBCL2L1MCL1BAK1
SCHEMBL11004527 0.78 LIPG (0.58) LIPGBIDBCL2L1MCL1BAK1
SCHEMBL11269006 0.78 LIPG (0.58) LIPGBIDBCL2L1MCL1BAK1
SCHEMBL8519828 0.78 LIPG (0.58) LIPGBIDBCL2L1MCL1BAK1

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-20100099875-A1 NEW ORTHO-FUNCTIONALIZED P-CHIRAL ARYLPHOSPHINES AND DERIVATIVES: THEIR PREPARATION AND USE IN ASYMMETRIC CATALYSIS PHOSPHOENIX SARL (FR) 2010-04-22 — — US disclosed
EP-1899358-A2 NOVEL P-CHIRAL FUNCTIONALISED ARYLPHOSPHINES AND DERIVATIVES, THE PREPARATION AND USE THEREOF FOR ASYMMETRICAL CATALYSIS Phosphoenix SARL (FR) 2008-03-19 — — EP disclosed
WO-2006136695-A2 NOVEL P-CHIRAL FUNCTIONALISED ARYLPHOSPHINES AND DERIVATIVES, THE PREPARATION AND USE THEREOF FOR ASYMMETRICAL CATALYSIS PHOSPHOENIX SARL (FR) 2006-12-28 — — 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-20100099875-A1 NEW ORTHO-FUNCTIONALIZED P-CHIRAL ARYLPHOSPHINES AND DERIVATIVES: THEIR PREPARATION AND USE IN ASYMMETRIC CATALYSIS PNP, NANP, PHOSPHO1 LIPG 652/4885MGLL 425/4885BCHE 232/4885

“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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