SCHEMBL25985599

SCHEMBL25985599

CC1(C)OB(c2ccc(C(c3ccccc3)(C(F)(F)F)C(F)(F)F)cc2)OC1(C)C

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 13/20 0.57
LPL P06858 12/20 0.57
F11 P03951 3/20 0.45
F2 P00734 2/20 0.45
PRSS1 P07477 2/20 0.45
PRSS2 P07478 2/20 0.45
PRSS3 P35030 2/20 0.45
P4HB P07237 1/20 0.43
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
CA12 O43570 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39

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
SCHEMBL21370131 0.93 LPL (0.53) LIPGLPLF11F2PRSS1
SCHEMBL26155637 0.87 LPL (0.47) LIPGLPLF11F2PRSS1
SCHEMBL25985572 0.87 LIPG (0.57) LIPGLPLF11F2PRSS1
SCHEMBL870004 0.87 LIPG (0.61) LIPGLPLF11F2PRSS1
SCHEMBL25981613 0.86 LIPG (0.56) LIPGLPLF11F2PRSS1
SCHEMBL21518564 0.86 LPL (0.46) LIPGLPLF11F2PRSS1
SCHEMBL25981605 0.85 LIPG (0.59) LIPGLPLF11F2PRSS1
SCHEMBL25985482 0.84 LIPG (0.54) LIPGLPLF11F2PRSS1
SCHEMBL24028674 0.83 LIPG (0.65) LIPGLPLF11F2PRSS1
SCHEMBL19305515 0.83 LIPG (0.65) LIPGLPLF11F2PRSS1

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-20230257383-A1 COMPOUND SERVING AS BTK INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF CHENGDU HYPERWAY PHARMACEUTICALS CO., LTD. (CN) 2023-08-17 US disclosed
EP-4186906-A1 COMPOUND AS BRAIN-PERMEABLE BTK OR HER2 INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF Chengdu Hyperway Pharmaceuticals Co., Ltd. (CN) 2023-05-31 EP 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-20230257383-A1 COMPOUND SERVING AS BTK INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF BTK, WEE1, WEE2 LIPG 3280/4885LPL 3691/4885F11 347/4885

“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.