SCHEMBL22892018

SCHEMBL22892018

CCOC(=O)c1cc(-c2ccc(C#N)cc2)n(-c2ccc(I)cc2)n1

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 3/20 0.58
CHRNA7 P36544 2/20 0.56
RPA1 P27694 1/20 0.51
KDM1A O60341 7/20 0.50
FAAH O00519 2/20 0.49
BCL2 P10415 2/20 0.47
MDM2 Q00987 2/20 0.47
MCL1 Q07820 2/20 0.47

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
SCHEMBL9206997 0.89 CHRNA7 (0.70) CA9CHRNA7RPA1KDM1AFAAH
SCHEMBL5148820 0.88 CA9 (0.57) CA9CHRNA7RPA1KDM1AFAAH
SCHEMBL20820101 0.88 KDM1A (0.57) CA9CHRNA7RPA1KDM1AFAAH
SCHEMBL8922991 0.88 CA9 (0.56) CA9CHRNA7RPA1KDM1AFAAH
SCHEMBL20820086 0.86 KDM1A (0.60) CA9CHRNA7KDM1AFAAH
SCHEMBL5524647 0.82 KMT2A (0.52) CA9CHRNA7RPA1KDM1AFAAH
SCHEMBL16876862 0.82 CA9 (0.55) CA9CHRNA7RPA1KDM1AFAAH
SCHEMBL18865603 0.82 GAA (0.49) CA9CHRNA7
SCHEMBL16797270 0.82 KMT2A (0.52) CA9
SCHEMBL16797379 0.80 KDM1A (0.60) CA9RPA1KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3681877-B1 PYRAZOLE DERIVATIVE COMPOUND AND USE THEREOF HANMI PHARMACEUTICAL CO LTD (KR) 2024-10-16 EP disclosed
CN-111094265-B Pyrazole derivative compound and use thereof 韩美药品株式会社 2023-07-25 CN disclosed
US-11254676-B2 Pyrazole derivative compound and use thereof HANMI PHARM. CO., LTD. (KR) 2022-02-22 US disclosed
US-11254676-B2 Pyrazole derivative compound and use thereof HANMI PHARM. CO., LTD. (KR) 2022-02-22 US disclosed
US-20210009591-A1 PYRAZOLE DERIVATIVE COMPOUND AND USE THEREOF HANMI PHARM. CO., LTD. (KR) 2021-01-14 US disclosed
US-20210009591-A1 PYRAZOLE DERIVATIVE COMPOUND AND USE THEREOF HANMI PHARM. CO., LTD. (KR) 2021-01-14 US disclosed
EP-3681877-A1 PYRAZOLE DERIVATIVE COMPOUND AND USE THEREOF Hanmi Pharm. Co., Ltd. (KR) 2020-07-22 EP disclosed
CN-111094265-A Pyrazole derivative compound and use thereof 韩美药品株式会社 2020-05-01 CN disclosed
WO-2019054766-A1 PYRAZOLE DERIVATIVE COMPOUND AND USE THEREOF HANMI PHARM. CO., LTD. (KR) 2019-03-21 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-20210009591-A1 PYRAZOLE DERIVATIVE COMPOUND AND USE THEREOF KDM1A, KDM3A, KDM1B CA9 3556/4885CHRNA7 2344/4885RPA1 2854/4885
US-11254676-B2 Pyrazole derivative compound and use thereof KDM1A, KDM3A, KDM1B CA9 3556/4885CHRNA7 2344/4885RPA1 2854/4885

“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.