SCHEMBL25493087

SCHEMBL25493087

Cc1cc(Cl)cc2c(C(C)C)c[nH]c12

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GABRA1 P14867 1/20 0.39
▸ GABRB1 P18505 1/20 0.39
▸ LMNA P02545 3/20 0.35
▸ AR P10275 1/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ PARP14 Q460N5 1/20 0.32
▸ SOS2 Q07890 1/20 0.32
▸ HTR2A P28223 1/20 0.31
▸ SCN4A P35499 2/20 0.31
▸ AHR P35869 1/20 0.31
▸ CYP1A2 P05177 1/20 0.30

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
SCHEMBL25493358 0.83 GABRA1 (0.41) GABRA1GABRB1LMNAARPARP14
SCHEMBL20697007 0.81 CYP1A2 (0.42) LMNAARPARP14SOS2CYP1A2
SCHEMBL27759814 0.80 TRIM24 (0.31) —
SCHEMBL5673618 0.78 GABRA1 (0.39) GABRA1GABRB1PARP14SOS2
SCHEMBL24215575 0.76 CD44 (0.39) LMNAARIDO1HTR2AAHR
SCHEMBL12244364 0.72 SOS2 (0.54) ARPARP14SOS2HTR2AAHR
SCHEMBL31375034 0.71 F7 (0.51) CYP1A2
SCHEMBL672970 0.71 TRIM24 (0.56) LMNACYP1A2
SCHEMBL12244358 0.70 HTR2A (0.55) IDO1HTR2A
SCHEMBL22308526 0.70 PARP14 (0.32) PARP14SOS2

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-20230142654-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF PIMEDBIO, INC. (KR) 2023-05-11 — — 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-20230142654-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF TYR, TYRO3, TH GABRA1 2849/4885GABRB1 3630/4885LMNA 4574/4885

“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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