SCHEMBL22062344

SCHEMBL22062344

Cc1cnc(F)c(SSc2cccnc2F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 3/20 0.40
▸ CCR5 P51681 3/20 0.40
▸ CCR8 P51685 3/20 0.40
▸ CYP3A4 P08684 2/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP2A6 P11509 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ PSMD14 O00487 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ AGTR1 P30556 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ NAPRT Q6XQN6 1/20 0.33

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
SCHEMBL22062343 0.82 NAPRT (0.43) CCR1CCR5CCR8CYP3A4ALDH1A1
SCHEMBL7229585 0.74 — —
SCHEMBL30096757 0.74 — —
SCHEMBL9038419 0.66 ADRA2A (0.38) CYP1A2ALDH1A1L3MBTL1KDM4EMEN1
SCHEMBL20502495 0.66 CCR1 (0.42) CCR1CCR5CCR8CYP1A2CYP2A6
SCHEMBL29876001 0.65 L3MBTL1 (0.39) CCR1CCR5CCR8CYP3A4CYP1A2
SCHEMBL130023 0.65 CYP1A2 (0.55) CCR1CCR5CCR8CYP1A2ALDH1A1
SCHEMBL9039754 0.63 PDE5A (0.47) ALDH1A1L3MBTL1KDM4EHPGDHTT
SCHEMBL9252734 0.63 — —
SCHEMBL30937183 0.63 — —

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-10676439-B2 Pentafluorosulfanyl pyridine UBE INDUSTRIES, LTD. (JP) 2020-06-09 — — 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-10676439-B2 Pentafluorosulfanyl pyridine AFF4, Q6ZSR9, AFF2 CCR1 491/4885CCR5 244/4885CCR8 205/4885

“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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