SCHEMBL25670588

SCHEMBL25670588

CC(C)(C)c1ncnc2ccc(O)cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.41
MAP4K4 O95819 1/20 0.40
ALK Q9UM73 2/20 0.39
ENPP1 P22413 1/20 0.39
RAF1 P04049 5/20 0.38
BRAF P15056 5/20 0.38
EGFR P00533 1/20 0.37
ERBB2 P04626 1/20 0.37
HTT P42858 5/20 0.37
NR1I2 O75469 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
CYP2C9 P11712 1/20 0.37
MIF P14174 1/20 0.37
TYR P14679 1/20 0.37
ALOX15 P16050 1/20 0.37
NFE2L2 Q16236 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CCNE2 O96020 1/20 0.37
CDK4 P11802 1/20 0.37

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
SCHEMBL25670582 0.86 EGFR (0.41) MAP4K4ALKEGFRHTTNR1I2
SCHEMBL21305275 0.80 FYN (0.42) EGFRALDH1A1ALOX15HSD17B10KDR
SCHEMBL21849276 0.80 HTT (0.47) PARP1MAP4K4HTTALDH1A1LMNA
SCHEMBL12744657 0.79 USP10 (0.45) PARP1MAP4K4HTT
SCHEMBL18177880 0.79 HTT (0.53) ALKHTTALDH1A1LMNAGLA
SCHEMBL14090669 0.79 CSF1R (0.48) PARP1MAP4K4EGFRERBB2HTT
SCHEMBL14090741 0.78 EGFR (0.38) ALKEGFRALDH1A1ALOX15HSD17B10
SCHEMBL12775544 0.76 MAPT (0.54) MAP4K4EGFRLMNA
SCHEMBL13043952 0.76 EGFR (0.47) EGFRHTTCCNE2CCNE1CDK2
SCHEMBL13599958 0.76 PARP1 (0.44) PARP1MAP4K4ALKENPP1RAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230277570-A1 ENPP1 Inhibitors and Their Use for the Treatment of Cancer THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2023-09-07 US disclosed
US-11707471-B2 ENPP1 inhibitors and their use for the treatment of cancer THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2023-07-25 US disclosed
US-11707471-B2 ENPP1 inhibitors and their use for the treatment of cancer THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2023-07-25 US disclosed
US-11701371-B2 ENPP1 inhibitors and their use for the treatment of cancer THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2023-07-18 US disclosed
US-20230190927-A1 ENPP1 INHIBITORS AND METHODS OF MODULATING IMMUNE RESPONSE CYANA THERAPEUTICS LLC 2023-06-22 US disclosed
US-20230190927-A1 ENPP1 INHIBITORS AND METHODS OF MODULATING IMMUNE RESPONSE CYANA THERAPEUTICS LLC 2023-06-22 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 (4 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-11701371-B2 ENPP1 inhibitors and their use for the treatment of cancer ENPP1, ENPP3, ENTPD1 PARP1 172/4885MAP4K4 1407/4885ALK 1248/4885
US-20230190927-A1 ENPP1 INHIBITORS AND METHODS OF MODULATING IMMUNE RESPONSE ENPP1, STING1, ENPP3 PARP1 1528/4885MAP4K4 1821/4885ALK 4363/4885
US-11707471-B2 ENPP1 inhibitors and their use for the treatment of cancer ENPP1, ENPP3, ENTPD1 PARP1 172/4885MAP4K4 1407/4885ALK 1248/4885
US-20230277570-A1 ENPP1 Inhibitors and Their Use for the Treatment of Cancer ENPP1, ENPP3, ENTPD1 PARP1 172/4885MAP4K4 1407/4885ALK 1248/4885

“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.