SCHEMBL25460863

SCHEMBL25460863

CNC(=O)C1(c2cccc(Cl)c2)CCCC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 6/20 0.55
▸ SLC6A4 P31645 4/20 0.51
▸ SLC6A3 Q01959 4/20 0.51
▸ SLC6A2 P23975 2/20 0.51
▸ CCR2 P41597 1/20 0.46
▸ EP300 Q09472 3/20 0.46
▸ CREBBP Q92793 3/20 0.46
▸ IDO1 P14902 2/20 0.45
▸ KCNH2 Q12809 1/20 0.45
▸ HDAC3 O15379 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC2 Q92769 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ HTT P42858 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ FTO Q9C0B1 1/20 0.42

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
SCHEMBL30603158 0.82 IDO1 (0.49) HDAC4SLC6A4SLC6A3SLC6A2CCR2
SCHEMBL29092831 0.82 IDO1 (0.49) HDAC4SLC6A4SLC6A3SLC6A2CCR2
SCHEMBL25460820 0.82 HDAC4 (0.55) HDAC4SLC6A4SLC6A3SLC6A2HDAC3
SCHEMBL25464568 0.81 IDO1 (0.55) HDAC4SLC6A4SLC6A3EP300CREBBP
SCHEMBL25460818 0.81 HDAC4 (0.73) HDAC4HDAC1SMN1; SMN2
SCHEMBL29886254 0.81 SLC6A4 (0.49) HDAC4SLC6A4SLC6A3SLC6A2CCR2
SCHEMBL28595250 0.81 SLC6A4 (0.49) HDAC4SLC6A4SLC6A3SLC6A2CCR2
SCHEMBL3110960 0.81 AKR1C1 (0.65) HDAC4SLC6A4SLC6A3SLC6A2CCR2
SCHEMBL12880247 0.81 ALDH1A1 (0.56) HDAC4SLC6A4SLC6A3SLC6A2CCR2
SCHEMBL16639040 0.80 HDAC4 (0.71) HDAC4HDAC1HTTSMN1; SMN2

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-20230151074-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS CARMOT THERAPEUTICS, INC. 2023-05-18 — — 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-20230151074-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS GIPR, GLP1R, GCGR HDAC4 2192/4885SLC6A4 1150/4885SLC6A3 741/4885

“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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