SCHEMBL23013548

SCHEMBL23013548

Cc1ccn2nc(-c3ccccc3F)c(C(=O)O)c2n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 8/20 0.41
▸ DHFR P00374 1/20 0.41
▸ ALKBH5 Q6P6C2 1/20 0.41
▸ HTR6 P50406 3/20 0.39
▸ PTGS2 P35354 1/20 0.39
▸ TGFBR1 P36897 1/20 0.36
▸ PRKD3 O94806 1/20 0.36
▸ CLK2 P49760 1/20 0.36
▸ DYRK1A Q13627 1/20 0.36
▸ PRKD2 Q9BZL6 1/20 0.36
▸ PIM2 Q9P1W9 1/20 0.36
▸ PARP1 P09874 1/20 0.36
▸ ADORA2A P29274 1/20 0.35
▸ ADORA2B P29275 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ MBNL1 Q9NR56 1/20 0.35

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
SCHEMBL29703800 1.00 DHODH (0.41) DHODHDHFRALKBH5HTR6PTGS2
SCHEMBL23023565 0.85 PTGS2 (0.42) DHODHDHFRALKBH5HTR6PTGS2
SCHEMBL29703797 0.85 ALDH1A1 (0.44) TGFBR1ALDH1A1KDM4ELMNAHSD17B10
SCHEMBL23013511 0.85 ALDH1A1 (0.44) TGFBR1ALDH1A1KDM4ELMNAHSD17B10
SCHEMBL23023602 0.81 HTR6 (0.41) HTR6PTGS2ADORA2AADORA2BADORA1
SCHEMBL29703795 0.80 MAOB (0.40) PARP1
SCHEMBL23013953 0.80 MAOB (0.40) PARP1
SCHEMBL23013809 0.80 DHODH (0.42) DHODHHTR6PTGS2ADORA2AALDH1A1
SCHEMBL25150574 0.80 PTGS2 (0.38) HTR6PTGS2ADORA2AADORA2BADORA1
SCHEMBL29703839 0.80 DHODH (0.42) DHODHHTR6PTGS2ADORA2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11634425-B2 Pharmaceutical compounds PFIZER INC. (US) 2023-04-25 — — US disclosed
US-11634425-B2 Pharmaceutical compounds PFIZER INC. (US) 2023-04-25 — — US disclosed
US-20220324873-A1 PHARMACEUTICAL COMPOUNDS PFIZER INC. 2022-10-13 — — US disclosed
EP-4017856-A1 PHARMACEUTICAL COMPOUNDS Reviral Limited (GB) 2022-06-29 — — EP disclosed
CN-114555604-A Pharmaceutical compounds 瑞威有限公司 2022-05-27 — — CN disclosed
WO-2021032992-A1 PHARMACEUTICAL COMPOUNDS ReViral Limited (GB) 2021-02-25 — — WO disclosed
WO-2021032992-A1 PHARMACEUTICAL COMPOUNDS ReViral Limited (GB) 2021-02-25 — — WO 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-11634425-B2 Pharmaceutical compounds GABRA6, CHRNA6, CNR1 DHODH 3256/4885DHFR 1384/4885ALKBH5 4370/4885
US-20220324873-A1 PHARMACEUTICAL COMPOUNDS GABRA6, CNR1, CHRNA6 DHODH 3350/4885DHFR 1288/4885ALKBH5 4457/4885

“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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