SCHEMBL22862657

SCHEMBL22862657

Cn1c(=O)n(C)c2cc(Cn3cnc4cc(C5CC5)ccc43)ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 3/20 0.47
▸ NTRK1 P04629 2/20 0.47
▸ NTRK2 Q16620 2/20 0.47
▸ TRIM24 O15164 1/20 0.40
▸ LMNA P02545 3/20 0.40
▸ HTT P42858 3/20 0.40
▸ NR1I2 O75469 1/20 0.39
▸ BRD4 O60885 2/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ TSHR P16473 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ UBE2N P61088 1/20 0.38
▸ CYP11B1 P15538 2/20 0.38
▸ CYP11B2 P19099 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ PDE2A O00408 2/20 0.37
▸ PDE1A P54750 2/20 0.37
▸ PDE1B Q01064 2/20 0.37
▸ PDE1C Q14123 2/20 0.37

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
SCHEMBL38653371 1.00 CSF1R (0.47) CSF1RNTRK1NTRK2TRIM24LMNA
SCHEMBL22862442 0.92 NTRK1 (0.41) CSF1RNTRK1NTRK2TRIM24LMNA
SCHEMBL29490261 0.92 NTRK1 (0.41) CSF1RNTRK1NTRK2TRIM24LMNA
SCHEMBL22862709 0.81 BRD4 (0.45) LMNAHTTNR1I2BRD4SMN1; SMN2
SCHEMBL29490198 0.81 BRD4 (0.45) LMNAHTTNR1I2BRD4SMN1; SMN2
SCHEMBL22862448 0.79 SMN1; SMN2 (0.42) LMNAHTTSMN1; SMN2TSHRL3MBTL1
SCHEMBL29490240 0.79 SMN1; SMN2 (0.42) LMNAHTTSMN1; SMN2TSHRL3MBTL1
SCHEMBL29490228 0.78 PDE2A (0.41) LMNAHTTSMN1; SMN2TSHRL3MBTL1
SCHEMBL22862649 0.78 PDE2A (0.41) LMNAHTTSMN1; SMN2TSHRL3MBTL1
SCHEMBL22862638 0.76 TRIM24 (0.42) TRIM24LMNAHTTBRD4SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220389028-A1 BAX INHIBITORS AND USES THEREOF CASE WESTERN RESERVE UNIVERSITY 2022-12-08 — — US disclosed
WO-2021002986-A2 BAX INHIBITORS AND USES THEREOF CASE WESTERN RESERVE UNIVERSITY (US) 2021-01-07 — — 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-20220389028-A1 BAX INHIBITORS AND USES THEREOF BAX, TMBIM6, BCL2 CSF1R 4716/4885NTRK1 4806/4885NTRK2 4630/4885

“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.

Send feedback