SCHEMBL23830981

SCHEMBL23830981

O=C(Nc1nc(Cl)ncc1F)C1CCCC1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.57
TSHR P16473 2/20 0.45
MEN1 O00255 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
MAPK1 P28482 1/20 0.43
TYK2 P29597 1/20 0.42
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ABL1 P00519 2/20 0.41
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
GSK3B P49841 2/20 0.40

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
SCHEMBL23830536 0.97 KMT2A (0.54) KMT2ATSHRMEN1SMN1; SMN2MAPK1
SCHEMBL23830465 0.88 HDAC1 (0.47) KMT2ATYK2ALDH1A1L3MBTL1ABL1
SCHEMBL23830455 0.80 KMT2A (0.53) KMT2AMEN1SMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL3333893 0.78 KMT2A (0.46) KMT2AABL1NPC1RAB9A
SCHEMBL24978407 0.78 HDAC3 (0.43) KMT2ATSHRMEN1SMN1; SMN2NPC1
SCHEMBL24978408 0.77 KMT2A (0.46) KMT2ATSHRMEN1SMN1; SMN2ABL1
SCHEMBL23330999 0.75 HDAC3 (0.40) KMT2ATSHRMEN1SMN1; SMN2TYK2
SCHEMBL10304417 0.75 KMT2A (0.65) KMT2AALDH1A1L3MBTL1
SCHEMBL2126296 0.75 KMT2A (0.65) KMT2AALDH1A1L3MBTL1
SCHEMBL10008045 0.75 KMT2A (0.65) KMT2AALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3883925-A1 CYCLIC UREAS Sironax Ltd (KY) 2021-09-29 EP disclosed
US-20210292305-A1 Cyclic Ureas SIRONAX LTD (KY) 2021-09-23 US disclosed
US-20210292305-A1 Cyclic Ureas SIRONAX LTD (KY) 2021-09-23 US disclosed
CN-113302183-A Cyclic ureas 圣瑞诺有限公司 2021-08-24 CN 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 (1 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-20210292305-A1 Cyclic Ureas RIPK1, RIPK3, RIPK4 KMT2A 4226/4885TSHR 1632/4885MEN1 3182/4885

“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.