SCHEMBL7018283

SCHEMBL7018283

O=C(O)N1CCC2(CC1)NC(=O)N(CCBr)C2=O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 3/20 0.43
KMT2A Q03164 3/20 0.41
POLB P06746 1/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.38
FPR2 P25090 3/20 0.38
KDM4E B2RXH2 1/20 0.37
AKR1B1 P15121 1/20 0.37

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
SCHEMBL21753311 0.82 NPC1 (0.47) TACR1KMT2ALMNAALDH1A1SMN1; SMN2
SCHEMBL7012505 0.80 TACR1 (0.43) TACR1KMT2ASMN1; SMN2MEN1KDM4E
SCHEMBL7211766 0.78 KMT2A (0.39) TACR1KMT2APOLBLMNAALDH1A1
SCHEMBL7099931 0.76 CRBN (0.40) TACR1KMT2AALDH1A1
SCHEMBL23610494 0.71 KMT2A (0.49) TACR1KMT2ALMNAALDH1A1SMN1; SMN2
SCHEMBL7211759 0.71 NPC1 (0.39) TACR1KMT2ALMNAMEN1AKR1B1
SCHEMBL7211763 0.71 TACR1 (0.37) TACR1KMT2APOLBLMNAALDH1A1
SCHEMBL4146171 0.68 USP30 (0.39) SMN1; SMN2KDM4E
SCHEMBL21150760 0.67 TACR1 (0.43) TACR1SMN1; SMN2KDM4E
SCHEMBL21753397 0.66 NPC1 (0.43) TACR1KMT2ALMNASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030187023-A1 Sulfone derivatives, process for their production and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-10-02 US disclosed
EP-1302462-A1 SULFONE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-04-16 EP 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-20030187023-A1 Sulfone derivatives, process for their production and use thereof SULT1E1, RRS1, SHH TACR1 1484/4885KMT2A 636/4885POLB 3954/4885

“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.