SCHEMBL26199528

SCHEMBL26199528

CC1(C)COB(c2cccc3c2CCCC3)O1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.38
BAD Q92934 1/20 0.38
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 2/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
CCR4 P51679 1/20 0.33
TSHR P16473 3/20 0.32
CXCR5 P32302 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31

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
SCHEMBL1900607 0.81 BCL2L1 (0.42) BCL2L1BADALDH1A1MEN1KMT2A
SCHEMBL15592746 0.80 BCL2L1 (0.41) BCL2L1BADALDH1A1MEN1KMT2A
SCHEMBL12667047 0.78 P2RX7 (0.39) BCL2L1BADALDH1A1MEN1KMT2A
SCHEMBL28546786 0.74 TSHR (0.31) TSHR
SCHEMBL30849833 0.73
SCHEMBL30768992 0.71 LPL (0.37) ALDH1A1MEN1KMT2ALMNA
SCHEMBL28499705 0.71 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ALMNATHRB
SCHEMBL20980942 0.70 FFAR1 (0.30)
SCHEMBL29592082 0.70 ALDH1A1 (0.30) ALDH1A1SMN1; SMN2
SCHEMBL29592069 0.70 TAAR1 (0.33) ALDH1A1LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 BCL2L1 226/4885BAD 231/4885ALDH1A1 2943/4885

“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.