SCHEMBL29633559

SCHEMBL29633559

CCOc1cc(C(C)NCCCCc2ccccc2)cc(COC)c1C

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RRM1 P23921 1/20 0.44
SIGMAR1 Q99720 9/20 0.42
KMT2A Q03164 2/20 0.40
BCHE P06276 1/20 0.38
SCN8A Q9UQD0 1/20 0.37
CALM1 P0DP23 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
SCHEMBL28709094 1.00 RRM1 (0.44) RRM1SIGMAR1KMT2ABCHESCN8A
SCHEMBL28711070 0.81 RRM1 (0.47) RRM1SIGMAR1KMT2ACALM1
SCHEMBL28702700 0.81 RRM1 (0.47) RRM1SIGMAR1KMT2ACALM1
SCHEMBL28711071 0.81 RRM1 (0.47) RRM1SIGMAR1KMT2ACALM1
SCHEMBL28702699 0.81 RRM1 (0.47) RRM1SIGMAR1KMT2ACALM1
Hydrochloric Acid SCHEMBL28715442 0.80 RRM1 (0.46) RRM1SIGMAR1KMT2ACALM1
Hydrochloric Acid SCHEMBL28715444 0.80 RRM1 (0.46) RRM1SIGMAR1KMT2ACALM1
SCHEMBL28715380 0.79 RRM1 (0.48) RRM1SIGMAR1KMT2A
SCHEMBL28715381 0.79 RRM1 (0.48) RRM1SIGMAR1KMT2A
SCHEMBL28715330 0.78 KMT2A (0.50) RRM1SIGMAR1KMT2A

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-12338203-B2 Urea compound for antagonizing LPA1 receptor TAISHO PHARMACEUTICAL CO., LTD. (JP) 2025-06-24 US disclosed
CN-119823001-A Urea compounds antagonizing LPA1 receptor 大正制药株式会社 2025-04-15 CN disclosed
CN-114206832-B Urea compounds antagonizing LPA1 receptor 大正制药株式会社 2025-04-04 CN disclosed
CN-114206832-A Urea compounds antagonizing LPA1 receptor 大正制药株式会社 2022-03-18 CN 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-12338203-B2 Urea compound for antagonizing LPA1 receptor LPAR1, LPAR2, LPAR3 RRM1 3843/4885SIGMAR1 236/4885KMT2A 2533/4885

“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.