SCHEMBL25839210

SCHEMBL25839210

Cc1cc2c(Cl)nnc(C(F)(F)F)c2cc1C

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
GLP1R P43220 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
SCHEMBL25546700 0.81 ALDH1A1 (0.36) ALDH1A1CYP1A2POLBCYP3A4CYP2C19
SCHEMBL23526090 0.80 PDE5A (0.38) ALDH1A1
SCHEMBL29945835 0.80 PDE5A (0.38) ALDH1A1
SCHEMBL23526292 0.73 NT5E (0.45)
SCHEMBL4115923 0.73 DYRK1A (0.44) ALDH1A1CYP1A2POLBCYP2C19
SCHEMBL25838975 0.73 ALDH1A1 (0.34) ALDH1A1POLB
SCHEMBL10077986 0.72 GOT1 (0.46) ALDH1A1POLB
SCHEMBL30327770 0.65 KDM4E (0.41)
SCHEMBL28961833 0.64 PDE5A (0.48)
SCHEMBL23525930 0.63 SOS1 (0.33)

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-11702418-B2 SOS1 inhibitors Mirati Therapeutics, Inc. (US) 2023-07-18 US disclosed
US-20230137886-A1 SOS1 INHIBITORS Mirati Therapeutics, Inc. 2023-05-04 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-20230137886-A1 SOS1 INHIBITORS SOS1, SOS2, SAV1 ALDH1A1 3260/4885CYP1A2 4781/4885POLB 3766/4885
US-11702418-B2 SOS1 inhibitors SOS1, SOS2, SOST ALDH1A1 3367/4885CYP1A2 4753/4885POLB 4505/4885

“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.