SCHEMBL21454934

SCHEMBL21454934

CC(C)(Br)C(=O)OC1CCCCCCC1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.54
EPHX1 P07099 2/20 0.44
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
NAAA Q02083 2/20 0.41
CHRM3 P20309 6/20 0.40
CYP2C19 P33261 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38

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
SCHEMBL23018464 1.00 CYP19A1 (0.54) CYP19A1EPHX1HTTSMN1; SMN2NPC1
SCHEMBL13220564 1.00 CYP19A1 (0.54) CYP19A1EPHX1HTTSMN1; SMN2NPC1
SCHEMBL4397862 1.00 CYP19A1 (0.54) CYP19A1EPHX1HTTSMN1; SMN2NPC1
SCHEMBL19609079 0.85 CYP19A1 (0.42) CYP19A1EPHX1HTTSMN1; SMN2NPC1
SCHEMBL2182130 0.83 CYP19A1 (0.53) CYP19A1EPHX1HTTSMN1; SMN2NPC1
SCHEMBL14606265 0.83 CYP19A1 (0.49) CYP19A1EPHX1HTTSMN1; SMN2NPC1
SCHEMBL28317353 0.83 CYP19A1 (0.53) CYP19A1EPHX1HTTSMN1; SMN2NPC1
SCHEMBL27581519 0.82 CYP19A1 (0.50) CYP19A1EPHX1HTTSMN1; SMN2NPC1
SCHEMBL19609078 0.82 CYP19A1 (0.40) CYP19A1EPHX1HTTSMN1; SMN2NPC1
SCHEMBL4679066 0.81 CYP19A1 (0.51) CYP19A1EPHX1HTTSMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210346866-A1 Functionalised Chromatography Medium Comprising Polymer Nanofibres and Process of Preparation Thereof CYTIVA BIOPROCESS R&D AB (SE) 2021-11-11 US disclosed
EP-3834926-A1 FUNCTIONALIZED CHROMATOGRAPHY MEDIA PURIDIFY LTD. (GB) 2021-06-16 EP disclosed
US-20210060527-A1 Chromatography Media and Methods for Producing Them CYTIVA BIOPROCESS R&D AB (SE) 2021-03-04 US disclosed
EP-3484613-B1 FUNCTIONALISED CHROMATOGRAPHY MEDIUM COMPRISING POLYMER NANOFIBRES AND PROCESS OF PREPARATION THEREOF PURIDIFY LTD (GB) 2021-02-24 EP disclosed
US-20190308169-A1 Functionalised Chromatography Medium Comprising Polymer Nanofibres and Process of Preparation Thereof CYTIVA BIOPROCESS R&D AB (SE) 2019-10-10 US 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-20190308169-A1 Functionalised Chromatography Medium Comprising Polymer Nanofibres and Process of Preparation Thereof C9, C1R, F3 CYP19A1 1718/4885EPHX1 813/4885HTT 2501/4885
US-20210346866-A1 Functionalised Chromatography Medium Comprising Polymer Nanofibres and Process of Preparation Thereof NEFM, SGMS1, FIBP CYP19A1 4513/4885EPHX1 4027/4885HTT 3382/4885

“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.