SCHEMBL25599276

SCHEMBL25599276

CCOC(=O)c1cc(-n2c(C)ccc2C)nn1CCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 5/20 0.39
POLB P06746 2/20 0.39
TDP1 Q9NUW8 4/20 0.38
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 5/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 2/20 0.36
CFTR P13569 1/20 0.34
NPC1 O15118 3/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
DUT P33316 1/20 0.32
KDM4E B2RXH2 2/20 0.32

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
SCHEMBL25594852 0.88 DUT (0.34) DUT
SCHEMBL15273722 0.84 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2POLBTDP1RAB9A
SCHEMBL31206724 0.83 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2POLBTDP1RAB9A
SCHEMBL2928812 0.83 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2POLBTDP1RAB9A
SCHEMBL26924584 0.81 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2POLBTDP1RAB9A
SCHEMBL31206669 0.81 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2POLBTDP1HTT
SCHEMBL30673263 0.80 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2POLBTDP1RAB9A
SCHEMBL25594850 0.78 DUT (0.33) DUT
SCHEMBL25594871 0.78 SMN1; SMN2 (0.52) ALDH1A1SMN1; SMN2POLBTDP1RAB9A
SCHEMBL29050070 0.78 SMN1; SMN2 (0.49) ALDH1A1SMN1; SMN2POLBTDP1HPGD

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-20230167110-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS SCHRÖDINGER, INC. 2023-06-01 US disclosed
WO-2023086319-A1 6-HE TERO ARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. (US) 2023-05-19 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-20230167110-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS JAK2, JAK3, STAT5B ALDH1A1 3735/4885SMN1; SMN2 4718/4885POLB 1228/4885

“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.