SCHEMBL23925472

SCHEMBL23925472

C[C@@H](Nc1c(-c2c(F)cc(I)cc2F)c(Cl)nc2ncnn12)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
KMT2A Q03164 2/20 0.33
TSHR P16473 2/20 0.33
POLB P06746 1/20 0.33
GAA P10253 2/20 0.31
MEN1 O00255 1/20 0.31
MAPK1 P28482 2/20 0.30
ALOX15 P16050 1/20 0.30
LMNA P02545 1/20 0.30
RAB9A P51151 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL23925473 1.00 ALDH1A1 (0.33) ALDH1A1KMT2ATSHRPOLBGAA
SCHEMBL28962131 0.96 ALDH1A1 (0.31) ALDH1A1KMT2ATSHRPOLB
SCHEMBL23925419 0.92 ALDH1A1 (0.33) ALDH1A1KMT2ATSHRPOLBGAA
SCHEMBL23925421 0.92 ALDH1A1 (0.33) ALDH1A1KMT2ATSHRPOLBGAA
SCHEMBL80486 0.91 MAPK1 (0.35) ALDH1A1KMT2ATSHRPOLBGAA
SCHEMBL3117730 0.91 MAPK1 (0.35) ALDH1A1KMT2ATSHRPOLBGAA
SCHEMBL977522 0.91 MAPK1 (0.35) ALDH1A1KMT2ATSHRPOLBGAA
SCHEMBL25616307 0.90 ALDH1A1 (0.35) ALDH1A1KMT2ATSHRPOLBGAA
SCHEMBL23925410 0.89 ALDH1A1 (0.34) ALDH1A1KMT2ATSHRPOLBGAA
SCHEMBL23925412 0.89 ALDH1A1 (0.34) ALDH1A1KMT2ATSHRPOLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230167121-A1 SUBSTITUTED {1,2,4,} TRIAZOLO{1,5-A} PYRIMIDINE COMPOUNDS AND USE IN STABILIZING MICROTUBULES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-06-01 US disclosed
US-20230167121-A1 SUBSTITUTED {1,2,4,} TRIAZOLO{1,5-A} PYRIMIDINE COMPOUNDS AND USE IN STABILIZING MICROTUBULES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-06-01 US disclosed
US-20230167121-A1 SUBSTITUTED {1,2,4,} TRIAZOLO{1,5-A} PYRIMIDINE COMPOUNDS AND USE IN STABILIZING MICROTUBULES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-06-01 US disclosed
EP-4136089-A1 SUBSTITUTED {1,2,4,} TRIAZOLO{1,5-A} PYRIMIDINE COMPOUNDS AND USE IN STABILIZING MICROTUBULES The Trustees of The University of Pennsylvania (US) 2023-02-22 EP disclosed
CN-115397826-A Substituted {1,2,4, } triazolo {1,5-a } pyrimidine compounds and their use for the stabilization of microtubules 宾夕法尼亚大学理事会 2022-11-25 CN disclosed
WO-2021211408-A1 SUBSTITUTED {1,2,4,} TRIAZOLO{1,5-A} PYRIMIDINE COMPOUNDS AND USE IN STABILIZING MICROTUBULES THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2021-10-21 WO disclosed
WO-2021211408-A1 SUBSTITUTED {1,2,4,} TRIAZOLO{1,5-A} PYRIMIDINE COMPOUNDS AND USE IN STABILIZING MICROTUBULES THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2021-10-21 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-20230167121-A1 SUBSTITUTED {1,2,4,} TRIAZOLO{1,5-A} PYRIMIDINE COMPOUNDS AND USE IN STABILIZING MICROTUBULES MAPT, TUBA4A, MAP4 ALDH1A1 2113/4885KMT2A 2234/4885TSHR 4078/4885

“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.