SCHEMBL21027978

SCHEMBL21027978

N#CC1CCc2cc3ccccc3n2C1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 5/20 0.45
▸ HTR2C P28335 5/20 0.45
▸ NOTUM Q6P988 1/20 0.38
▸ SIGMAR1 Q99720 6/20 0.33
▸ EGLN2 Q96KS0 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HTR1A P08908 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
SCHEMBL231854 0.78 HTR2A (0.51) HTR2AHTR2CNOTUMSIGMAR1
SCHEMBL233436 0.78 HTR2A (0.47) HTR2AHTR2CNOTUMSIGMAR1KDM4E
SCHEMBL8447299 0.77 HTR2A (0.45) HTR2AHTR2CNOTUMSIGMAR1EGLN2
SCHEMBL31244687 0.77 PDE4B (0.36) EGLN2MEN1KMT2AKDM4EALDH1A1
SCHEMBL8447696 0.73 HTR2A (0.43) HTR2AHTR2CNOTUMSIGMAR1
SCHEMBL13448722 0.72 HTR2A (0.42) HTR2AHTR2CNOTUMSIGMAR1
SCHEMBL8654307 0.72 HTR2A (0.43) HTR2AHTR2CNOTUMSIGMAR1
SCHEMBL8658423 0.72 HTR2A (0.43) HTR2AHTR2CNOTUMSIGMAR1
SCHEMBL18911621 0.70 HTR2A (0.73) HTR2AHTR2CNOTUMSIGMAR1HTR1A
SCHEMBL13279281 0.70 HTR2A (0.40) HTR2AHTR2CNOTUMSIGMAR1

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 HTR2A 604/4885HTR2C 749/4885NOTUM 3876/4885
US-11524958-B2 Tricyclic compound as CRTH2 inhibitor NR1H2, NR3C2, NR1H4 HTR2A 772/4885HTR2C 1011/4885NOTUM 3644/4885

“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.

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