SCHEMBL22968432

SCHEMBL22968432

Cc1nc2ncnn2c(N)c1C

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
MBOAT4 Q96T53 15/20 0.49
ALDH1A1 P00352 1/20 0.47
ENPP1 P22413 1/20 0.43
PAX2 Q02962 1/20 0.43

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
SCHEMBL610731 0.81 MBOAT4 (0.47) TSHRMBOAT4ALDH1A1ENPP1
SCHEMBL353089 0.80 HSD17B10 (0.55) TSHRALDH1A1ENPP1PAX2
SCHEMBL21222854 0.78 MBOAT4 (0.56) MBOAT4
SCHEMBL611241 0.78 TSHR (0.48) TSHRMBOAT4ALDH1A1
SCHEMBL21222988 0.78 MBOAT4 (0.56) MBOAT4
SCHEMBL5199168 0.77 TSHR (0.50) TSHRALDH1A1ENPP1PAX2
SCHEMBL10407277 0.77 TSHR (0.50) TSHRALDH1A1ENPP1PAX2
SCHEMBL10407276 0.77 TSHR (0.50) TSHRMBOAT4ALDH1A1ENPP1PAX2
SCHEMBL7819692 0.77 TSHR (0.50) TSHRALDH1A1ENPP1PAX2
SCHEMBL14503825 0.76 MBOAT4 (0.46) MBOAT4ALDH1A1

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-11583532-B2 Triazolopyrimidine derivatives for use as ghrelin o-acyl transferase (GOAT) inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-02-21 US disclosed
EP-3746443-B1 TRIAZOLOPYRIMIDINE DERIVATIVES FOR USE AS GHRELIN O-ACYL TRANSFERASE (GOAT) INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2022-07-06 EP disclosed
US-20210038603-A1 TRIAZOLOPYRIMIDINE DERIVATIVES FOR USE AS GHRELIN O-ACYL TRANSFERASE (GOAT) INHIBITORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2021-02-11 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-20210038603-A1 TRIAZOLOPYRIMIDINE DERIVATIVES FOR USE AS GHRELIN O-ACYL TRANSFERASE (GOAT) INHIBITORS MBOAT4, GIPR, MTTP TSHR 16/4885MBOAT4 1/4885ALDH1A1 407/4885
US-11583532-B2 Triazolopyrimidine derivatives for use as ghrelin o-acyl transferase (GOAT) inhibitors MBOAT4, GIPR, MTTP TSHR 16/4885MBOAT4 1/4885ALDH1A1 407/4885

“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.