SCHEMBL25937265

SCHEMBL25937265

CC[C@@H]1CC[C@@H](Oc2ccc(F)c(F)c2Br)C1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.33
HTR2C P28335 4/20 0.33
HTR2B P41595 4/20 0.33
KDM1A O60341 4/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
TRPV3 Q8NET8 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
SCHEMBL25937266 0.88 HTR2C (0.36) HTR2AHTR2CHTR2BSLC6A4
SCHEMBL25937260 0.81 MCHR1 (0.40) HTR2AHTR2CHTR2BKDM1ASLC6A2
SCHEMBL25937272 0.81 MCHR1 (0.40) HTR2AHTR2CHTR2BKDM1ASLC6A2
SCHEMBL25937271 0.78 HTR2C (0.32) HTR2CHTR2BSLC6A4
SCHEMBL25937264 0.74 S1PR5 (0.31)
SCHEMBL25937262 0.74 SCD (0.34) KDM1A
SCHEMBL17072236 0.73 KDM1A (0.33) KDM1A
SCHEMBL25937293 0.72 S1PR4 (0.37)
SCHEMBL25937261 0.70 MCHR1 (0.39) HTR2AHTR2CHTR2BSLC6A2SLC6A4
SCHEMBL25937273 0.70 MCHR1 (0.39) HTR2AHTR2CHTR2BSLC6A2SLC6A4

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-20230310423-A1 CHECKPOINT KINASE 1 (CHK1) INHIBITORS AND USES THEREOF BOUNDLESS BIO, INC. 2023-10-05 US disclosed
US-11707462-B2 Checkpoint kinase 1 (CHK1) inhibitors and uses thereof BOUNDLESS BIO, INC. (US) 2023-07-25 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-20230310423-A1 CHECKPOINT KINASE 1 (CHK1) INHIBITORS AND USES THEREOF CHEK1, CHEK2, RAD1 HTR2A 4678/4885HTR2C 4504/4885HTR2B 4686/4885
US-11707462-B2 Checkpoint kinase 1 (CHK1) inhibitors and uses thereof CHEK1, CHEK2, RAD1 HTR2A 4678/4885HTR2C 4504/4885HTR2B 4686/4885

“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.