SCHEMBL6932097

SCHEMBL6932097

O=C(C=P)OC(Cc1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP2C9 P11712 1/20 0.42
HIF1A Q16665 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CETP P11597 4/20 0.39
CYP3A4 P08684 1/20 0.37
RECQL P46063 1/20 0.37
CHRM1 P11229 3/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
KCNH2 Q12809 2/20 0.36
OPRM1 P35372 2/20 0.36
OPRD1 P41143 2/20 0.36
MRGPRX2 Q96LB1 1/20 0.36
CHRM3 P20309 1/20 0.36
HRH2 P25021 1/20 0.36
HTR2A P28223 1/20 0.36
ADRA1A P35348 1/20 0.36
OPRK1 P41145 1/20 0.36

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
SCHEMBL9728260 0.81 HIF1A (0.47) CYP1A2CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL2484068 0.81 CYP1A2 (0.48) CYP1A2CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL5846769 0.81 CYP2C19 (0.48) CYP1A2CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL9189250 0.78 ALDH1A1 (0.47) CYP1A2CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL12478787 0.78 CYP2C19 (0.46) CYP1A2CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL1535931 0.77 ALDH1A1 (0.43) CYP1A2CYP2C19CYP2C9HIF1ASMN1; SMN2
Phosphine SCHEMBL6248436 0.77 ALDH1A1 (0.46) CYP1A2CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL27379939 0.75 KMT2A (0.39) CYP1A2CYP2C19HIF1AKIF11ALDH1A1
Hydrochloric Acid SCHEMBL3839265 0.74 MAPK1 (0.49) CYP1A2CYP2C19CYP2C9HIF1ASMN1; SMN2
Phosphine SCHEMBL8857165 0.74 CYP1A2 (0.42) CYP1A2CYP2C19CYP2C9HIF1ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3645548-B1 METHODS FOR PREPARING BILE ACIDS MEDYTOX INC (KR) 2023-11-29 EP disclosed
US-20220009957-A1 Methods for Preparing Bile Acids MEDYTOX INC. (KR) 2022-01-13 US disclosed
US-11161872-B2 Methods for preparing bile acids MEDYTOX INC. (KR) 2021-11-02 US disclosed
US-20200369712-A1 METHODS FOR PREPARING BILE ACIDS WUXI APPTEC (SHANGHAI) CO., LTD. (CN) 2020-11-26 US disclosed
EP-3645548-A1 METHODS FOR PREPARING BILE ACIDS Medytox Inc. (KR) 2020-05-06 EP disclosed
WO-2019024920-A1 METHODS FOR PREPARING BILE ACIDS MEDYTOX INC. (KR) 2019-02-07 WO disclosed
EP-1363869-B1 PROCESS FOR THE PREPARATION OF ALKYL BENZOYLACRYLATES WEYLCHEM LAMOTTE (FR) 2015-04-08 EP disclosed
EP-1363869-A2 PROCESS FOR THE PREPARATION OF ALKYL BENZOYLACRYLATES Clariant (France) S.A. (FR) 2003-11-26 EP disclosed
WO-2002067847-A2 PROCESS FOR THE PREPARATION OF ALKYL BENZOYLACRYLATES CLARIANT (FRANCE) (FR) 2002-09-06 WO disclosed
EP-0665224-A1 PYRIMIDINE DERIVATIVE NIPPON SODA CO., LTD. (JP) 1995-08-02 EP disclosed
US-4021479-A ANTIPHLOGISTICS AND ANTIPROLIFERATIVES BOEHRINGER INGELHEIM GMBH (DT) 1977-05-03 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 (3 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-20220009957-A1 Methods for Preparing Bile Acids DHCR7, CYP46A1, CYP27A1 CYP1A2 100/4885CYP2C19 115/4885CYP2C9 78/4885
US-20200369712-A1 METHODS FOR PREPARING BILE ACIDS DHCR7, CYP46A1, CYP27A1 CYP1A2 100/4885CYP2C19 115/4885CYP2C9 78/4885
US-11161872-B2 Methods for preparing bile acids DHCR7, CYP46A1, CYP27A1 CYP1A2 100/4885CYP2C19 115/4885CYP2C9 78/4885

“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.