SCHEMBL21028086

SCHEMBL21028086

COC(=O)C1CCc2cc3cc(Cl)ccc3n2C1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
AHR P35869 1/20 0.38
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MMP14 P50281 1/20 0.37
ADAMTS5 Q9UNA0 1/20 0.37
RXFP1 Q9HBX9 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
SCHEMBL21028295 0.85 SIGMAR1 (0.38) ALDH1A1
SCHEMBL21027979 0.84 HTR2A (0.43) ALDH1A1HTR2AHTR2C
SCHEMBL21028298 0.74 TSHR (0.48) SMN1; SMN2MEN1ALDH1A1KMT2AMAPT
SCHEMBL21028329 0.74 ALDH1A1 (0.40) SMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL8328343 0.71 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1HTR2AHTR2CMAPT
SCHEMBL17907979 0.69 PTGDR2 (0.39) KMT2AHTR2AHTR2C
SCHEMBL16695469 0.69 NOTUM (0.52) SMN1; SMN2MEN1ALDH1A1KMT2AMAPT
SCHEMBL8450784 0.68 HTR2A (0.39) HTR2AHTR2C
SCHEMBL24214577 0.67 FAAH (0.43) SMN1; SMN2MEN1ALDH1A1KMT2AMAPT
SCHEMBL29958397 0.67 MAPT (0.43) SMN1; SMN2MEN1ALDH1A1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11524958-B2 Tricyclic compound as CRTH2 inhibitor CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-12-13 US disclosed
US-20210403466-A1 TRICYCLIC COMPUND AS CRTH2 INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2021-12-30 US disclosed
EP-3489235-A1 TRICYCLIC COMPOUND AS CRTH2 INHIBITOR Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2019-05-29 EP 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-20210403466-A1 TRICYCLIC COMPUND AS CRTH2 INHIBITOR NR3C2, CRHR2, CRHR1 SMN1; SMN2 2171/4885MEN1 1870/4885ALDH1A1 3257/4885
US-11524958-B2 Tricyclic compound as CRTH2 inhibitor NR1H2, NR3C2, NR1H4 SMN1; SMN2 2715/4885MEN1 2955/4885ALDH1A1 3139/4885

“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.