SCHEMBL25222695

SCHEMBL25222695

Cc1cccc(-c2nccc(Nc3ccnc(Nc4ccc5c(c4)CC(N)C5)n3)n2)n1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 1/20 0.46
▸ JAK2 O60674 3/20 0.41
▸ JAK3 P52333 3/20 0.41
▸ EGFR P00533 2/20 0.41
▸ TERT O14746 1/20 0.41
▸ DOT1L Q8TEK3 1/20 0.41
▸ PLK1 P53350 2/20 0.40
▸ SYK P43405 2/20 0.39
▸ KDR P35968 1/20 0.39
▸ TGFBR1 P36897 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 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
SCHEMBL30086467 1.00 IGF1R (0.46) IGF1RJAK2JAK3EGFRTERT
SCHEMBL23887623 0.82 ACVR1 (0.44) IGF1RJAK2JAK3EGFRPLK1
SCHEMBL30086651 0.82 ACVR1 (0.44) IGF1RJAK2JAK3EGFRPLK1
SCHEMBL30086810 0.81 BTK (0.49) IGF1R
SCHEMBL23906276 0.81 BTK (0.49) IGF1R
SCHEMBL23906566 0.81 TERT (0.49) EGFRTERTDOT1LSYKKDR
SCHEMBL30086556 0.81 TERT (0.49) EGFRTERTDOT1LSYKKDR
SCHEMBL25260684 0.81 TERT (0.49) JAK2JAK3EGFRTERTDOT1L
SCHEMBL30086538 0.81 TERT (0.49) JAK2JAK3EGFRTERTDOT1L
SCHEMBL25255420 0.80 JAK2 (0.47) IGF1RJAK2JAK3EGFRPLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230399312-A1 SUBSTITUTED PYRIMIDINES AND METHODS OF USE THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-12-14 — — US disclosed
US-20230399312-A1 SUBSTITUTED PYRIMIDINES AND METHODS OF USE THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-12-14 — — US disclosed
US-11673879-B2 Substituted pyrimidines and methods of use THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-06-13 — — US disclosed
US-11673879-B2 Substituted pyrimidines and methods of use THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-06-13 — — 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 (2 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-11673879-B2 Substituted pyrimidines and methods of use ALK, TYMP, ENTPD5 IGF1R 558/4885JAK2 1187/4885JAK3 1474/4885
US-20230399312-A1 SUBSTITUTED PYRIMIDINES AND METHODS OF USE ALK, TYMP, ENTPD5 IGF1R 558/4885JAK2 1187/4885JAK3 1474/4885

“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.

Send feedback