SCHEMBL3264745

SCHEMBL3264745

CCN1CCC(N2CCC(N)CC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.46
GNAI3 P08754 1/20 0.44
GNAO1 P09471 1/20 0.44
GNAI1 P63096 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
OPRM1 P35372 2/20 0.38
OPRL1 P41146 2/20 0.38
OPRK1 P41145 1/20 0.38
SPHK1 Q9NYA1 1/20 0.36
CHRM1 P11229 1/20 0.36
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
ACHE P22303 1/20 0.34
TLR9 Q9NR96 2/20 0.34
TLR7 Q9NYK1 2/20 0.34
HRH3 Q9Y5N1 1/20 0.33
DPP4 P27487 1/20 0.33

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
Hydrochloric Acid SCHEMBL3264620 0.98 GNAI3 (0.47) KMT2AGNAI3GNAO1GNAI1SMN1; SMN2
SCHEMBL684220 0.87
SCHEMBL17946979 0.85 KMT2A (0.47) KMT2ASMN1; SMN2OPRM1OPRL1CHRM1
Hydrochloric Acid SCHEMBL23247778 0.84 GNAI3 (0.57) KMT2AGNAI3GNAO1GNAI1SMN1; SMN2
Hydrochloric Acid SCHEMBL3277895 0.84 GNAI3 (0.57) KMT2AGNAI3GNAO1GNAI1SMN1; SMN2
SCHEMBL1202619 0.83 KMT2A (0.42) KMT2AGNAI3GNAO1GNAI1SMN1; SMN2
SCHEMBL11919045 0.82 KMT2A (0.56) KMT2ASMN1; SMN2ACHE
SCHEMBL11919058 0.82 KMT2A (0.56) KMT2ASMN1; SMN2OPRM1OPRL1KDM4E
SCHEMBL11919193 0.81 KDM4E (0.50) KMT2ASMN1; SMN2OPRM1OPRL1KDM4E
Dimethylamine SCHEMBL6945951 0.80 GNAI3 (0.48) GNAI3GNAO1GNAI1SMN1; SMN2SPHK1

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
WO-2022111526-A1 BENZENE RING DERIVATIVE, AND COMPOSITION AND PHARMACEUTICAL USE THEREOF 四川海思科制药有限公司 2022-06-02 WO disclosed
US-20100075973-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-25 US disclosed
WO-2010025073-A1 DIHYDROIMIDAZO [ 1, 5-F] PTERIDINES AS POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-04 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 (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-20100075973-A1 POLO-LIKE KINASE INHIBITORS PLK2, PLK4, PLK1 KMT2A 2265/4885GNAI3 2138/4885GNAO1 2840/4885

“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.