SCHEMBL24372547

SCHEMBL24372547

SCCCCCc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC2 Q92769 3/20 0.45
▸ HDAC1 Q13547 2/20 0.45
▸ SIGMAR1 Q99720 2/20 0.43
▸ HSD11B1 P28845 2/20 0.42
▸ TAAR1 Q96RJ0 1/20 0.42
▸ HDAC3 O15379 1/20 0.41
▸ HDAC4 P56524 1/20 0.41
▸ HDAC7 Q8WUI4 1/20 0.41
▸ HDAC10 Q969S8 1/20 0.41
▸ HDAC11 Q96DB2 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ HDAC9 Q9UKV0 1/20 0.41
▸ HDAC5 Q9UQL6 1/20 0.41
▸ RARB P10826 4/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ RARA P10276 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MTOR P42345 1/20 0.41

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
SCHEMBL24372602 0.93 TAAR1 (0.44) HDAC2HDAC1HSD11B1TAAR1FDFT1
SCHEMBL24372593 0.91 SIGMAR1 (0.47) HDAC2HDAC1SIGMAR1HDAC3HDAC4
SCHEMBL22004489 0.88 HDAC2 (0.51) HDAC2HDAC1SIGMAR1HSD11B1TAAR1
SCHEMBL12316354 0.86 TAAR1 (0.47) HSD11B1TAAR1MEN1ALDH1A1MAPT
SCHEMBL15076231 0.85 HSD11B1 (0.58) HSD11B1RARBMEN1ALDH1A1RARA
SCHEMBL24372435 0.84 KCNH2 (0.46) SIGMAR1MEN1ALDH1A1MAPTKMT2A
SCHEMBL12316356 0.82 TAAR1 (0.42) TAAR1MEN1ALDH1A1MAPTKMT2A
SCHEMBL24372592 0.82 FFAR1 (0.50) HDAC2HDAC1HSD11B1TAAR1FDFT1
SCHEMBL14063940 0.81 RARB (0.57) HSD11B1RARBMEN1ALDH1A1RARA
SCHEMBL12386345 0.81 HSD11B1 (0.58) HSD11B1TAAR1RARBMEN1ALDH1A1

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-20220127286-A1 LIGANDS FOR NANO-SIZED MATERIALS MERCK PATENT GMBH (DE) 2022-04-28 — — 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-20220127286-A1 LIGANDS FOR NANO-SIZED MATERIALS L1CAM, EPCAM, SELPLG HDAC2 4617/4885HDAC1 4342/4885SIGMAR1 764/4885

“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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