SCHEMBL26196844

SCHEMBL26196844

O=C(O)c1nccn1CCOCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEAD3 Q99594 2/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
SRD5A2 P31213 1/20 0.40
ESR1 P03372 1/20 0.40
LTA4H P09960 1/20 0.40
MAOA P21397 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
SCHEMBL26196832 0.92 MAOB (0.40) TEAD3HDAC3HDAC4HDAC1HDAC7
SCHEMBL23043142 0.87 SMN1; SMN2 (0.43) TEAD3HDAC3HDAC4HDAC1HDAC7
SCHEMBL24129178 0.84 LTA4H (0.38) TEAD3HDAC3HDAC4HDAC1HDAC7
SCHEMBL2453175 0.81 TBXAS1 (0.48) MEN1KMT2ATSHR
SCHEMBL28701444 0.81 FLT1 (0.49) ESR1ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL23043559 0.79 LTA4H (0.40) TEAD3HDAC3HDAC4HDAC1HDAC7
SCHEMBL23053810 0.78 ALDH1A1 (0.46) KMT2ALTA4HALDH1A1SMN1; SMN2HTT
SCHEMBL28713079 0.78 KDM4A (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL23043044 0.78 LTA4H (0.43) KMT2ALTA4HMAOAMAOBTSHR
SCHEMBL18839799 0.78 ALDH1A1 (0.47) MEN1GAAKMT2AALDH1A1RAB9A

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-20230279025-A1 KRAS G12D INHIBITORS ARRAY BIOPHARMA INC. 2023-09-07 US disclosed
US-20230279025-A1 KRAS G12D INHIBITORS ARRAY BIOPHARMA INC. 2023-09-07 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 (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-20230279025-A1 KRAS G12D INHIBITORS KRAS, NRAS, HRAS TEAD3 334/4885HDAC3 3894/4885HDAC4 3699/4885

“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.