SCHEMBL10227709

SCHEMBL10227709

O=Pc1ccnn1-c1c(-c2ccccc2)nn(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 6/20 0.40
CDK2 P24941 6/20 0.40
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
EGFR P00533 1/20 0.36
SRC P12931 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
POLB P06746 1/20 0.36
PTGS2 P35354 2/20 0.36
PTGS1 P23219 1/20 0.36
CDK1 P06493 1/20 0.36
CDK4 P11802 1/20 0.36
CCNB1 P14635 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
SCHEMBL409808 0.80 CA1 (0.41) CCNA2CDK2CA1CA2MEN1
SCHEMBL12930022 0.80 CYP2C9 (0.43) CCNA2CDK2CA1CA2MEN1
SCHEMBL18922436 0.78 POLB (0.52) KMT2ACYP2C9CYP2C19POLB
SCHEMBL28599216 0.74 MEN1 (0.37) CCNA2CDK2CA1CA2MEN1
SCHEMBL140011 0.73 CA1 (0.37) CCNA2CDK2CA1CA2MEN1
SCHEMBL18806835 0.73 CA1 (0.37) CCNA2CDK2CA1CA2MEN1
SCHEMBL1332907 0.73 HTR2A (0.37) CCNA2CDK2CA1CA2MEN1
SCHEMBL18802300 0.73 CA1 (0.37) CCNA2CDK2CA1CA2MEN1
SCHEMBL411222 0.73 CACNA1G (0.44) CCNA2CDK2CA1CA2MEN1
SCHEMBL12930005 0.73 MEN1 (0.46) CA1CA2MEN1KMT2ACYP1A2

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-8841487-B2 Phosphine ligands for catalytic reactions ABBVIE INC. (US) 2014-09-23 US disclosed
US-20120022252-A1 PHOSPHINE LIGANDS FOR CATALYTIC REACTIONS ABBOTT LABORATORIES (US) 2012-01-26 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-20120022252-A1 PHOSPHINE LIGANDS FOR CATALYTIC REACTIONS PHOSPHO1, PPIP5K2, ITPA CCNA2 1199/4885CDK2 275/4885CA1 1227/4885

“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.