SCHEMBL30497635

SCHEMBL30497635

CC1(C)OB(c2ccc(C(=O)Nc3cc(OC(F)F)ccn3)cc2)OC1(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
CA9 Q16790 3/20 0.45
DYRK1A Q13627 5/20 0.44
WNT1 P04628 3/20 0.44
GSK3B P49841 2/20 0.44
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
PKM P14618 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CXCR2 P25025 1/20 0.41
CLK2 P49760 1/20 0.40
CLK3 P49761 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MITF O75030 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
XBP1 P17861 1/20 0.39
HTT P42858 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
SCHEMBL15878197 0.90 CA1 (0.48) CA1CA2CA9DYRK1AWNT1
SCHEMBL14636502 0.88 F2 (0.48) CA1CA2CA9NPC1RAB9A
SCHEMBL30497644 0.88 F2 (0.48) CA1CA2CA9NPC1RAB9A
SCHEMBL14637526 0.86 RAB9A (0.57) CA1CA2CA9NPC1RAB9A
SCHEMBL14654242 0.85 CA1 (0.47) CA1CA2CA9NPC1RAB9A
SCHEMBL14637978 0.83 NPC1 (0.44) CA1CA2CA9DYRK1AWNT1
SCHEMBL14630277 0.83 CA1 (0.49) CA1CA2CA9NPC1RAB9A
SCHEMBL30497637 0.83 CA1 (0.49) CA1CA2CA9NPC1RAB9A
SCHEMBL30497638 0.82 NPC1 (0.58) CA1CA2CA9NPC1RAB9A
SCHEMBL14630208 0.82 NPC1 (0.58) CA1CA2CA9NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250074911-A1 MACROCYCLIC BTK INHIBITORS CROSSFIRE ONCOLOGY HOLDING B.V. (NL) 2025-03-06 US disclosed
EP-4448523-A1 MACROCYCLIC BTK INHIBITORS Crossfire Oncology Holding B.V. (NL) 2024-10-23 EP disclosed
WO-2023110970-A1 MACROCYCLIC BTK INHIBITORS NETHERLANDS TRANSLATIONAL RESEARCH CENTER HOLDING B.V (NL) 2023-06-22 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-20250074911-A1 MACROCYCLIC BTK INHIBITORS BTK, LYN, LCK CA1 4754/4885CA2 3735/4885CA9 4506/4885

“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.