SCHEMBL30892966

SCHEMBL30892966

O=C(NCC1CCC(c2nc(-c3ccc(C(F)(F)F)nc3)no2)CC1)c1cc(F)c(O)cc1F

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 2/20 0.47
▸ HDAC6 Q9UBN7 2/20 0.47
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CNR2 P34972 6/20 0.41
▸ MAPK14 Q16539 1/20 0.40
▸ KIT P10721 2/20 0.39
▸ CYP1A2 P05177 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ GABRA5 P31644 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ P2RX7 Q99572 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37

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
SCHEMBL27395307 1.00 HDAC4 (0.47) HDAC4HDAC6CA12CA1CA2
SCHEMBL29318609 0.88 CNR2 (0.41) HDAC4HDAC6CNR2CYP1A2CYP3A4
SCHEMBL27394716 0.88 CNR2 (0.41) HDAC4HDAC6CNR2CYP1A2CYP3A4
SCHEMBL30892989 0.88 CNR2 (0.41) HDAC4HDAC6CNR2CYP1A2CYP3A4
SCHEMBL27395308 0.86 HDAC4 (0.41) HDAC4HDAC6CNR2CYP1A2CYP3A4
SCHEMBL29318688 0.86 HDAC4 (0.41) HDAC4HDAC6CNR2CYP1A2CYP3A4
SCHEMBL27395305 0.83 HDAC6 (0.35) HDAC4HDAC6CNR2KITHDAC8
SCHEMBL29318607 0.77 CNR2 (0.41) HDAC4HDAC6CNR2CYP1A2CYP3A4
SCHEMBL30892975 0.77 CNR2 (0.41) HDAC4HDAC6CNR2CYP1A2CYP3A4
SCHEMBL27394713 0.77 CNR2 (0.41) HDAC4HDAC6CNR2CYP1A2CYP3A4

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-20240238425-A1 HSD17B13 Inhibitors and/or Degraders PFIZER INC. (US) 2024-07-18 — — US disclosed
US-20240150334-A1 HSD17B13 INHIBITORS AND/OR DEGRADERS PFIZER INC. (US) 2024-05-09 — — 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 (2 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-20240238425-A1 HSD17B13 Inhibitors and/or Degraders HSD17B13, HSD17B3, HSD17B1 HDAC4 450/4885HDAC6 888/4885CA12 2425/4885
US-20240150334-A1 HSD17B13 INHIBITORS AND/OR DEGRADERS HSD17B1, HSD17B3, HSD17B13 HDAC4 513/4885HDAC6 645/4885CA12 3053/4885

“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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