SCHEMBL823210

SCHEMBL823210

Cc1cc(C(=O)NCCc2cccc(C(F)(F)F)c2)c2c(C(=O)O)ccc3c2c1C(=O)N(C(F)(F)C(F)(F)C(F)(F)CF)C3=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
ROCK2 O75116 1/20 0.37
ROCK1 Q13464 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NAMPT P43490 1/20 0.36
DGAT2 Q96PD7 1/20 0.35
CNR1 P21554 1/20 0.35
CCR1 P32246 3/20 0.35
NPSR1 Q6W5P4 2/20 0.35
PARP1 P09874 1/20 0.35
MYC P01106 1/20 0.34
HSP90AA1 P07900 1/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL12175652 0.82 PDE4A (0.40) PDE4APDE4BPDE4CPDE4DROCK2
SCHEMBL12175382 0.81 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DROCK2
SCHEMBL12104731 0.75 NPC1 (0.47) PDE4APDE4BPDE4CPDE4DROCK2
SCHEMBL823211 0.75 MEN1 (0.43) PDE4APDE4BPDE4CPDE4DROCK2
SCHEMBL823209 0.66 MEN1 (0.49) ALDH1A1SMN1; SMN2MYCMAPTMEN1
SCHEMBL823207 0.65 THRB (0.49) KDM4EALDH1A1CNR1MYCMAPT
SCHEMBL12104600 0.65 THRB (0.47) KDM4EALDH1A1CNR1MYCMAPT
SCHEMBL4536310 0.65 CNR1 (0.62) KDM4ENAMPTCNR1MAPTMEN1
SCHEMBL16352054 0.64 NPC1 (0.59) ALDH1A1SMN1; SMN2CNR1MYCMAPT
SCHEMBL2212466 0.64 NPC1 (0.59) ALDH1A1SMN1; SMN2CNR1MYCMAPT

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-8314265-B2 Aromatic amic acids or amic esters and compositions EASTMAN KODAK COMPANY (US) 2012-11-20 US disclosed
US-20110269967-A1 AROMATIC AMIC ACIDS OR AMIC ESTERS AND COMPOSITIONS BANK OF AMERICA, N.A., AS AGENT 2011-11-03 US disclosed
WO-2011137137-A1 SEMICONDUCTING ARTICLES EASTMAN KODAK COMPANY (US) 2011-11-03 WO disclosed
US-20110266523-A1 SEMICONDUCTING DEVICES AND METHODS OF PREPARING BANK OF AMERICA, N.A., AS AGENT 2011-11-03 US disclosed
US-20110269966-A1 SEMICONDUCTING ARTICLES CITICORP NORTH AMERICA, INC., AS AGENT 2011-11-03 US disclosed
US-20110269265-A1 METHODS OF PREPARING SEMICONDUCTIVE COMPOSITIONS AND DEVICES KODAK REALTY INC. 2011-11-03 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 (2 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-20110269966-A1 SEMICONDUCTING ARTICLES ALAD, PORCN, DDC PDE4A 3338/4885PDE4B 3890/4885PDE4C 1850/4885
US-20110269967-A1 AROMATIC AMIC ACIDS OR AMIC ESTERS AND COMPOSITIONS DDC, AADAC, MYOC PDE4A 2984/4885PDE4B 3604/4885PDE4C 1953/4885

“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.