SCHEMBL20408357

SCHEMBL20408357

CCc1cc(CCC(=O)OC)nn1C1CCCCO1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 3/20 0.35
▸ CYP4A11 Q02928 3/20 0.35
▸ RXRA P19793 1/20 0.35
▸ RXRB P28702 1/20 0.35
▸ RXRG P48443 1/20 0.35
▸ ATR Q13535 4/20 0.33
▸ POLQ O75417 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.32
▸ CCR5 P51681 1/20 0.32
▸ PDE8B O95263 1/20 0.32
▸ MGLL Q99685 1/20 0.32
▸ HCRTR1 O43613 1/20 0.31
▸ HCRTR2 O43614 1/20 0.31
▸ POLB P06746 2/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ SLC6A3 Q01959 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ LMNA P02545 1/20 0.30

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
SCHEMBL20408356 0.81 CYP4F2 (0.38) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL20408352 0.79 CYP4F2 (0.35) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL3903187 0.75 RXRA (0.38) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL20408353 0.75 RXRA (0.35) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL20382691 0.74 SMYD3 (0.38) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL24103620 0.74 GAA (0.43) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL20408351 0.70 HTR2C (0.32) —
SCHEMBL25934594 0.70 RXRA (0.38) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL18587281 0.70 CYP4F2 (0.38) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL31416821 0.69 CYP4F2 (0.41) CYP4F2CYP4A11RXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180208588-A1 HETEROCYCLIC COMPOUNDS AND USE THEREOF NATIONAL HEALTH RES INST (TW) 2018-07-26 — — 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-20180208588-A1 HETEROCYCLIC COMPOUNDS AND USE THEREOF CXCL12, HPGDS, CX3CR1 CYP4F2 1271/4885CYP4A11 638/4885RXRA 627/4885

“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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