SCHEMBL22802202

SCHEMBL22802202

O=C(NC(C(=O)NCCCc1cccnc1)c1ccc(Cl)cc1)c1ccc2cc(F)ccc2c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 2/20 0.51
▸ PTAFR P25105 8/20 0.47
▸ F10 P00742 1/20 0.45
▸ PRSS1 P07477 1/20 0.45
▸ RAB9A P51151 1/20 0.42
▸ TBXAS1 P24557 2/20 0.42
▸ CTSL P07711 1/20 0.42
▸ CTSS P25774 1/20 0.42
▸ CNR1 P21554 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ GPR132 Q9UNW8 1/20 0.41
▸ KMT2A Q03164 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
SCHEMBL20777203 1.00 NAMPT (0.51) NAMPTPTAFRF10PRSS1RAB9A
SCHEMBL20777174 0.87 GPR132 (0.51) NAMPTPTAFRTBXAS1CTSLCTSS
SCHEMBL22802207 0.87 GPR132 (0.51) NAMPTPTAFRTBXAS1CTSLCTSS
SCHEMBL20777191 0.83 F10 (0.64) NAMPTF10PRSS1RAB9ACTSL
SCHEMBL20777192 0.83 F10 (0.64) NAMPTF10PRSS1RAB9ACTSL
SCHEMBL22802198 0.78 NAMPT (0.42) NAMPTPTAFRTBXAS1CNR1CNR2
SCHEMBL22822786 0.76 NPC1 (0.48) F10PRSS1RAB9ACTSLCNR1
SCHEMBL20777169 0.76 CTSL (0.49) RAB9ACTSLCTSSCNR1CNR2
SCHEMBL15162082 0.74 HDAC8 (0.56) PTAFRRAB9ATBXAS1CNR1CNR2
SCHEMBL22802205 0.74 NAMPT (0.41) NAMPTPTAFRTBXAS1HDAC8

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12371406-B2 Dual acting FKBP12 and FKBP52 inhibitors PLEX PHARMACEUTICALS, INC. (US) 2025-07-29 — — US disclosed
US-12065407-B2 Dual acting FKBP12 and FKBP52 inhibitors PLEX PHARMACEUTICALS, INC. (US) 2024-08-20 — — US disclosed
US-20210395203-A1 DUAL ACTING FKBP12 AND FKBP52 INHIBITORS PLEX PHARMACEUTICALS, INC. 2021-12-23 — — US disclosed
US-20200399219-A1 DUAL ACTING FKBP12 AND FKBP52 INHIBITORS PLEX PHARMACEUTICALS, INC. 2020-12-24 — — 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 (4 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-20200399219-A1 DUAL ACTING FKBP12 AND FKBP52 INHIBITORS FKBP2, FKBP1B, FKBP1A NAMPT 2597/4885PTAFR 2518/4885F10 3682/4885
US-20210395203-A1 DUAL ACTING FKBP12 AND FKBP52 INHIBITORS FKBP2, FKBP1B, FKBP1A NAMPT 2597/4885PTAFR 2518/4885F10 3682/4885
US-12065407-B2 Dual acting FKBP12 and FKBP52 inhibitors FKBP2, FKBP1B, FKBP1A NAMPT 2597/4885PTAFR 2518/4885F10 3682/4885
US-12371406-B2 Dual acting FKBP12 and FKBP52 inhibitors FKBP2, FKBP1B, FKBP1A NAMPT 2597/4885PTAFR 2518/4885F10 3682/4885

“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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