SCHEMBL23830455

SCHEMBL23830455

O=C(CC1CCCC1)Nc1nc(Cl)ncc1F

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.53
MEN1 O00255 2/20 0.47
ALPL P05186 1/20 0.47
POLB P06746 1/20 0.47
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
GAA P10253 1/20 0.46
EPHX2 P34913 3/20 0.45
KCNQ3 O43525 5/20 0.43
KCNQ2 O43526 5/20 0.43
P2RX7 Q99572 3/20 0.43
ALDH1A1 P00352 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ROCK2 O75116 1/20 0.41
KDM4E B2RXH2 1/20 0.40
AAK1 Q2M2I8 1/20 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
SCHEMBL23830981 0.80 KMT2A (0.57) KMT2AMEN1POLBNPC1RAB9A
SCHEMBL23830536 0.77 KMT2A (0.54) KMT2AMEN1POLBNPC1RAB9A
SCHEMBL23830479 0.74 KDM4E (0.48) KMT2ANPC1RAB9ASMN1; SMN2GAA
SCHEMBL23331245 0.74 P2RX7 (0.40) KMT2AMEN1ALPLPOLBNPC1
SCHEMBL23331244 0.72 P2RX7 (0.43) KMT2AMEN1ALPLPOLBNPC1
SCHEMBL22866360 0.71 KMT2A (0.97) KMT2AALDH1A1L3MBTL1KDM4E
SCHEMBL23830465 0.71 HDAC1 (0.47) KMT2AALDH1A1L3MBTL1
SCHEMBL5980561 0.71 EPHX2 (0.39) KMT2AMEN1NPC1RAB9ASMN1; SMN2
SCHEMBL13550224 0.70 ALDH1A1 (0.56) KMT2ASMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL657615 0.70 KMT2A (1.00) KMT2AMEN1GAAALDH1A1L3MBTL1

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-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 4226/4885MEN1 3182/4885ALPL 4102/4885

“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.