SCHEMBL19080441

SCHEMBL19080441

Cc1c(-c2c(F)cc(Br)c3ccccc23)c2ccccc2c2ccccc12

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPRT1 P00492 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ PRNP P04156 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ ACHE P22303 1/20 0.30
▸ KCNJ11 Q14654 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
SCHEMBL19063374 0.79 RCE1 (0.38) CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9
SCHEMBL19064470 0.78 KDM4E (0.44) ALDH1A1CYP1A2CYP2C9HPGDSMN1; SMN2
SCHEMBL19080431 0.77 CYP1A2 (0.42) CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9
SCHEMBL19080434 0.76 CYP1A2 (0.41) CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9
SCHEMBL19064465 0.72 HPRT1 (0.38) CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9
SCHEMBL5084276 0.72 ALDH1A1 (0.40) CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9
SCHEMBL19063384 0.70 MAPT (0.63) ALDH1A1HPRT1MEN1MAPTHPGD
SCHEMBL19080430 0.70 POLB (0.47) CYP2C19ALDH1A1CYP1A2CYP2C9HPRT1
SCHEMBL19064466 0.70 HPRT1 (0.39) CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9
SCHEMBL13755371 0.70 ALDH1A1 (0.37) CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9

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-20170194571-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 — — 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-20170194571-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNA1 CYP2D6 1892/4885CYP2C19 249/4885ALDH1A1 237/4885

“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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