SCHEMBL23328248

SCHEMBL23328248

CN(C)C1CCN(c2ccc(C(C)(C)C)c(F)c2)CC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.42
NPY5R Q15761 2/20 0.40
SOS1 Q07889 1/20 0.39
EED O75530 1/20 0.39
SETD2 Q9BYW2 4/20 0.39
NSD2 O96028 1/20 0.39
NOTUM Q6P988 3/20 0.38
NTRK1 P04629 1/20 0.37
JAK2 O60674 1/20 0.36
BRD4 O60885 1/20 0.36
RORC P51449 2/20 0.35
PLK1 P53350 1/20 0.35
CYP3A4 P08684 1/20 0.35
L3MBTL3 Q96JM7 1/20 0.35
TMEM97 Q5BJF2 1/20 0.34
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL29303949 0.84 CTSK (0.41) HSD11B1SOS1NOTUMNTRK1RORC
SCHEMBL21558832 0.81 SETD2 (0.47) HSD11B1NPY5RSOS1EEDSETD2
SCHEMBL23328575 0.81 SUV39H2 (0.43) HSD11B1PLK1
SCHEMBL21718972 0.80 MAPT (0.41)
SCHEMBL12590434 0.80 GRIN1 (0.39)
SCHEMBL20374556 0.79 NPY5R (0.41) HSD11B1NPY5REEDSETD2NSD2
SCHEMBL21718911 0.79 ALDH1A1 (0.42)
SCHEMBL11947316 0.77 HTR3A (0.47)
SCHEMBL17083418 0.76 P2RY1 (0.45) HSD11B1NSD2
SCHEMBL26074518 0.76 ADRB1 (0.51) CYP3A4SIGMAR1

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-11365196-B2 FGFR inhibitor and application thereof BETTA PHARMACEUTICALS CO., LTD. (CN) 2022-06-21 US disclosed
US-20210130353-A1 FGFR INHIBITOR AND APPLICATION THEREOF BETTA PHARMACEUTICALS CO., LTD. (CN) 2021-05-06 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 (2 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-11365196-B2 FGFR inhibitor and application thereof FGFR1, FGFR4, FGFR2 HSD11B1 921/4885NPY5R 1543/4885SOS1 2518/4885
US-20210130353-A1 FGFR INHIBITOR AND APPLICATION THEREOF FGFR1, FGFR4, FGFR2 HSD11B1 1077/4885NPY5R 1255/4885SOS1 2805/4885

“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.