SCHEMBL19566548

SCHEMBL19566548

O=C(NCC(F)(F)c1ccc(-c2ccc(Cl)cc2)cc1Cl)c1cccnc1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 1/20 0.45
▸ SCN2A Q99250 2/20 0.40
▸ SCN10A Q9Y5Y9 2/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ SCN5A Q14524 1/20 0.40
▸ MCHR1 Q99705 1/20 0.39
▸ CNR2 P34972 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.37
▸ HPGD P15428 2/20 0.36
▸ LIPG Q9Y5X9 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ GRM4 Q14833 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ P2RX7 Q99572 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 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
SCHEMBL19566553 0.93 HDAC6 (0.44) HDAC6CNR2GRM4LMNAP2RX7
SCHEMBL19566560 0.92 HDAC6 (0.45) HDAC6SCN2ASCN10AKCNH2SCN5A
SCHEMBL16212574 0.92 HDAC6 (0.48) HDAC6CNR2KDM4EHPGDGRM4
SCHEMBL19566563 0.91 HDAC6 (0.44) HDAC6SCN2ASCN10AKCNH2SCN5A
SCHEMBL16771887 0.89 HDAC6 (0.43) HDAC6MCHR1CNR2GRM4P2RX7
SCHEMBL18503592 0.88 HDAC6 (0.42) HDAC6CNR2GRM4P2RX7CYP1A2
SCHEMBL19566550 0.84 P2RX7 (0.47) KDM4EHPGDLIPGLMNAPOLB
SCHEMBL16211922 0.82 HDAC6 (0.55) HDAC6MCHR1CNR2HPGDALDH1A1
SCHEMBL17713159 0.82 HDAC6 (0.46) HDAC6CNR2LMNACYP1A2CYP2C9
SCHEMBL19566561 0.82 HDAC6 (0.46) HDAC6CNR2LMNACYP1A2CYP2C9

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-20170320848-A1 COMPOUNDS FOR USE IN ANTHELMINTHIC TREATMENT BAYER ANIMAL HEALTH GMBH (DE) 2017-11-09 — — US disclosed
US-20170320848-A1 COMPOUNDS FOR USE IN ANTHELMINTHIC TREATMENT BAYER ANIMAL HEALTH GMBH (DE) 2017-11-09 — — 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-20170320848-A1 COMPOUNDS FOR USE IN ANTHELMINTHIC TREATMENT ACHE, COX5B, TUBB6 HDAC6 278/4885SCN2A 1993/4885SCN10A 2144/4885

“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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