SCHEMBL19301652

SCHEMBL19301652

CCc1ncc(F)cc1C(C)C

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGBL2 Q5U5Z8 1/20 0.39
HRH4 Q9H3N8 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
SCHEMBL25555490 0.78 NOS3 (0.33)
SCHEMBL27863935 0.76 AGBL2 (0.33) AGBL2
SCHEMBL16491238 0.75 HRH4 (0.33) AGBL2HRH4
SCHEMBL19301653 0.74 P2RX3 (0.38)
SCHEMBL16386043 0.74 AGBL2 (0.59) AGBL2
SCHEMBL22842950 0.74 AGBL2 (0.46) AGBL2
SCHEMBL12190545 0.74 AGBL2 (0.34) AGBL2HRH4
SCHEMBL15159216 0.74 ALOX5AP (0.32) AGBL2HRH4
SCHEMBL23508963 0.72 AGBL2 (0.41) AGBL2
SCHEMBL12191685 0.72 JAK2 (0.38) HRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11198681-B2 Heteroaryl inhibitors of PAD4 PADLOCK THERAPEUTICS, INC. (US) 2021-12-14 US disclosed
US-11091486-B2 Process for the preparation of pyrazolo[1,5-a]pyrimidines and salts thereof ARRAY BIOPHARMA, INC (US) 2021-08-17 US disclosed
US-20210188810-A1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS INC (US) 2021-06-24 US disclosed
US-20200216451-A1 PROCESS FOR THE PREPARATION OF PYRAZOLO[1,5-a]PYRIMIDINES AND SALTS THEREOF ARRAY BIOPHARMA, INC. 2020-07-09 US disclosed
WO-2017147102-A1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS, INC. (US) 2017-08-31 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 (4 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-20210188810-A1 HETEROARYL INHIBITORS OF PAD4 PADI4, PADI1, PADI6 AGBL2 701/4885HRH4 2464/4885
US-11091486-B2 Process for the preparation of pyrazolo[1,5-a]pyrimidines and salts thereof DPYD, TYMP, UMPS AGBL2 4742/4885HRH4 3172/4885
US-20200216451-A1 PROCESS FOR THE PREPARATION OF PYRAZOLO[1,5-a]PYRIMIDINES AND SALTS THEREOF DPYD, TYMP, UMPS AGBL2 4742/4885HRH4 3172/4885
US-11198681-B2 Heteroaryl inhibitors of PAD4 PADI4, PADI1, PADI6 AGBL2 701/4885HRH4 2464/4885

“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.