SCHEMBL13931411

SCHEMBL13931411

O=C(O)Cc1cn(Cc2ccc(Oc3ccccc3F)cc2)c2ccccc12

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.56
▸ LMNA P02545 1/20 0.56
▸ CXCL8 P10145 1/20 0.50
▸ PPARD Q03181 4/20 0.49
▸ HTT P42858 2/20 0.49
▸ MAPT P10636 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ ICMT O60725 1/20 0.48
▸ MCL1 Q07820 3/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ PPARG P37231 3/20 0.47
▸ PPARA Q07869 3/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ POLB P06746 1/20 0.46
▸ PLA2G2A P14555 1/20 0.46
▸ TP53 P04637 1/20 0.46

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
SCHEMBL8181052 0.93 ALDH1A1 (0.56) ALDH1A1LMNAPPARDHTTMAPT
SCHEMBL8174939 0.92 ALDH1A1 (0.58) ALDH1A1LMNAPPARDHTTMAPT
SCHEMBL8181055 0.92 ALDH1A1 (0.55) ALDH1A1LMNAPPARDHTTMAPT
SCHEMBL8180730 0.90 ALDH1A1 (0.60) ALDH1A1LMNAPPARDHTTMAPT
SCHEMBL8167405 0.89 ALDH1A1 (0.59) ALDH1A1LMNAPPARDHTTMAPT
SCHEMBL8181354 0.89 LMNA (0.62) ALDH1A1LMNACXCL8PPARDHTT
SCHEMBL8178901 0.88 ALDH1A1 (0.60) ALDH1A1LMNACXCL8PPARDICMT
SCHEMBL13931026 0.87 ALDH1A1 (0.65) ALDH1A1LMNAPPARDHTTICMT
SCHEMBL8186676 0.87 ALDH1A1 (0.54) ALDH1A1LMNAPPARDICMTMCL1
SCHEMBL8178250 0.87 ALDH1A1 (0.56) ALDH1A1LMNAPPARDICMTMCL1

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-20090047246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2009-02-19 — — US disclosed
US-20090047246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2009-02-19 — — 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-20090047246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION EIF2AK2, HAVCR2, HCCS ALDH1A1 1836/4885LMNA 2969/4885CXCL8 805/4885

“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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