SCHEMBL29633692

SCHEMBL29633692

CCOc1cc(C(C)=O)cc2c1ncn2CC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 2/20 0.41
TSHR P16473 4/20 0.40
CYP3A4 P08684 2/20 0.40
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C19 P33261 2/20 0.36
POLB P06746 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL28715350 1.00 CREBBP (0.41) CREBBPTSHRCYP3A4LMNAMAPK1
SCHEMBL309368 0.78 KDM4E (0.41) TSHRCYP3A4SMN1; SMN2KMT2AKDM4E
SCHEMBL31140540 0.73 TSHR (0.46) TSHRLMNASMN1; SMN2KMT2APOLB
SCHEMBL30966545 0.71 ALDH1A1 (0.39) CREBBPTSHRKDM4EPOLBALDH1A1
SCHEMBL30223782 0.71 ALDH1A1 (0.39) CREBBPTSHRKDM4EPOLBALDH1A1
SCHEMBL6112726 0.71 NPC1 (0.52) SMN1; SMN2POLBHTT
SCHEMBL22946110 0.71 CREBBP (0.45) CREBBPTSHRCYP3A4MAPK1SMN1; SMN2
SCHEMBL22945777 0.70 CREBBP (0.54) CREBBPTSHRCYP3A4LMNAMAPK1
SCHEMBL22946087 0.70 CREBBP (0.54) CREBBPTSHRCYP3A4LMNAMAPK1
SCHEMBL13446665 0.70 TSHR (0.70) CREBBPTSHRCYP3A4LMNASMN1; SMN2

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 CREBBP 933/4885TSHR 733/4885CYP3A4 4572/4885

“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.