SCHEMBL3535783

SCHEMBL3535783

CC[CH]C(CC)c1cccnc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
GOPC Q9HD26 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.40
CYP19A1 P11511 1/20 0.40
GAA P10253 1/20 0.39
ITGB3 P05106 1/20 0.39
ITGAV P06756 1/20 0.39
CHRNB2 P17787 1/20 0.38
CHRNA4 P43681 1/20 0.38
KCNA5 P22460 2/20 0.38
KCNN4 O15554 1/20 0.38
KCNH2 Q12809 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
SCHEMBL27508499 0.82 CFTR (0.44) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL7045556 0.82 SMN1; SMN2 (0.47) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL3534814 0.77 LMNA (0.46) LMNA
SCHEMBL658876 0.75 CFTR (0.57) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL12154822 0.75 CFTR (0.52) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL1245510 0.73 NPC1 (0.53) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL22113733 0.73 NPC1 (0.53) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL14233502 0.73 NPC1 (0.53) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL19606204 0.72 SMN1; SMN2 (0.42) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL21162240 0.72 SMN1; SMN2 (0.39) CFTRSLC6A2SLC6A4SLC6A3GOPC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230123589-A1 MOLECULAR MOBILITY ENHANCER OR MOLECULAR DRYING ENHANCER TEKDRY INTERNATIONAL, INC. 2023-04-20 US disclosed
EP-4097386-A1 MOLECULAR MOBILITY ENHANCER OR MOLECULAR DRYING ENHANCER TekDry International, Inc. (US) 2022-12-07 EP disclosed
WO-2021154959-A1 MOLECULAR MOBILITY ENHANCER OR MOLECULAR DRYING ENHANCER TEKDRY INTERNATIONAL, INC. (US) 2021-08-05 WO disclosed
US-7714099-B2 Luminescent compositions and their uses HITACHI CHEMICAL CO., LTD. (JP) 2010-05-11 US disclosed
US-20060083945-A1 New luminescent compositions and their uses HITACHI CHEMICAL CO. LTD. (JP) 2006-04-20 US disclosed
WO-2006041221-A1 NEW LUMINESCENT COMPOSITIONS AND THEIR USES HITACHI CHEMICAL CO., LTD. (JP) 2006-04-20 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 (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-20060083945-A1 New luminescent compositions and their uses OCIAD1, NLRP3, OCIAD2 CFTR 3764/4885SLC6A2 3980/4885SLC6A4 2228/4885
US-20230123589-A1 MOLECULAR MOBILITY ENHANCER OR MOLECULAR DRYING ENHANCER SNRPE, MTREX, MMP20 CFTR 180/4885SLC6A2 4298/4885SLC6A4 3331/4885

“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.