SCHEMBL24099472

SCHEMBL24099472

NC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.58
MAP2 P11137 1/20 0.57
PPARG P37231 5/20 0.55
MPO P05164 2/20 0.52
APOL1 O14791 2/20 0.52
EGFR P00533 1/20 0.51
SRC P12931 1/20 0.51
PTGS2 P35354 1/20 0.49
TUBB4A P04350 1/20 0.48
TUBB P07437 1/20 0.48
TUBA3C P0DPH7 1/20 0.48
TUBA1B P68363 1/20 0.48
TUBA4A P68366 1/20 0.48
TUBB4B P68371 1/20 0.48
TUBB3 Q13509 1/20 0.48
TUBB2A Q13885 1/20 0.48
TUBB8 Q3ZCM7 1/20 0.48
TUBA3E Q6PEY2 1/20 0.48
TUBA1A Q71U36 1/20 0.48
TUBA1C Q9BQE3 1/20 0.48

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
SCHEMBL24098682 0.92 PPARG (0.59) TACR1MAP2PPARGMPOAPOL1
SCHEMBL6929600 0.91 PPARG (0.66) TACR1MAP2PPARGAPOL1EGFR
SCHEMBL7231716 0.86 PPARG (0.60) TACR1MAP2PPARGEGFR
SCHEMBL22160213 0.85 EGFR (0.62) PPARGAPOL1EGFRSRC
SCHEMBL24098678 0.84 PPARG (0.66) TACR1PPARGAPOL1EGFR
SCHEMBL30218312 0.84 PPARG (0.66) TACR1PPARGAPOL1EGFR
SCHEMBL24099201 0.83 TACR1 (0.55) TACR1PPARGAPOL1EGFRSRC
SCHEMBL28906368 0.81 KDM4E (0.51) TACR1MAP2PPARGPTGS2TUBB4A
SCHEMBL22161253 0.81 TACR1 (0.49) TACR1PPARGPTGS2TUBB4ATUBB
SCHEMBL22160189 0.81 GPR17 (0.57) TACR1PPARGEGFRSRCTUBB4A

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-20230014907-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED 2023-01-19 US disclosed
WO-2021252849-A1 INHIBITORS OF APOL1 AND USE OF THE SAME VERTEX PHARMACEUTICALS INCORPORATED (US) 2021-12-16 WO 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-20230014907-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME APOL1, APOB, NPC1L1 TACR1 3857/4885MAP2 4302/4885PPARG 2747/4885

“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.