Benzaldehyde

Benzaldehyde

SCHEMBL4091798

CCCNCCC.O=Cc1ccccc1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
CYP2A6 P11509 2/20 0.61
DRD2 P14416 1/20 0.42
DRD4 P21917 1/20 0.42
DRD3 P35462 1/20 0.42
ALDH3A1 P30838 1/20 0.42
ALDH1A3 P47895 1/20 0.42
SIGMAR1 Q99720 2/20 0.41
LMNA P02545 2/20 0.41
EGFR P00533 1/20 0.40
HDAC3 O15379 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPC1 O15118 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HTR1B P28222 1/20 0.39
TSHR P16473 1/20 0.38
AKR1C3 P42330 1/20 0.38
KMT2A Q03164 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 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
Benzaldehyde SCHEMBL1169911 0.88 ALDH1A1 (0.56) ALDH1A1CYP2A6DRD2DRD4DRD3
Benzaldehyde SCHEMBL3088932 0.86 ALDH1A1 (0.74) ALDH1A1CYP2A6ALDH3A1ALDH1A3LMNA
Benzaldehyde SCHEMBL9879104 0.84 SIGMAR1 (0.58) ALDH1A1CYP2A6SIGMAR1LMNAEGFR
Benzaldehyde SCHEMBL9746116 0.84 SIGMAR1 (0.58) ALDH1A1CYP2A6SIGMAR1LMNAEGFR
Benzaldehyde SCHEMBL2832223 0.84 SIGMAR1 (0.58) ALDH1A1CYP2A6SIGMAR1LMNAEGFR
Benzaldehyde SCHEMBL27520789 0.84 ALDH1A1 (0.78) ALDH1A1CYP2A6ALDH3A1ALDH1A3LMNA
Benzaldehyde SCHEMBL28129001 0.82 ALDH1A1 (0.67) ALDH1A1CYP2A6ALDH3A1ALDH1A3SIGMAR1
Benzaldehyde SCHEMBL316996 0.82 ALDH1A1 (0.67) ALDH1A1CYP2A6ALDH3A1ALDH1A3LMNA
Benzaldehyde SCHEMBL27780817 0.81 ALDH1A1 (0.74) ALDH1A1CYP2A6ALDH3A1ALDH1A3LMNA
Styrene SCHEMBL8063766 0.81 ALDH1A1 (0.58) ALDH1A1CYP2A6DRD2DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2491915-B1 EASILY REMOVABLE CURABLE COMPOSITION FOR DENTAL USE SUN MEDICAL CO LTD (JP) 2019-07-03 EP disclosed
CN-108409757-A A kind of Zn complex and its preparation method and application 阜阳师范学院 2018-08-17 CN disclosed
US-8362105-B2 Dental curable composition and kit for such dental curable composition SUN MEDICAL CO., LTD. (JP) 2013-01-29 US disclosed
EP-2491915-A1 EASILY REMOVABLE CURABLE COMPOSITION FOR DENTAL USE SUN MEDICAL CO., LTD. (JP) 2012-08-29 EP disclosed
US-20120213832-A1 REMOVABLE DENTAL CURABLE COMPOSITION SUN MEDICAL CO., LTD. (JP) 2012-08-23 US disclosed
US-20090258966-A1 Dental Composition NIHON UNIVERSITY (JP) 2009-10-15 US disclosed
US-20090137697-A1 Dental Curable Composition and Kit for Such Dental Curable Composition SUN MEDICAL CO., LTD. (JP) 2009-05-28 US disclosed
EP-1938781-A1 DENTAL CURABLE COMPOSITION AND KIT FOR SUCH DENTAL CURABLE COMPOSITION SUN MEDICAL CO., LTD. (JP) 2008-07-02 EP disclosed
US-20070191520-A1 Photo-radically curable resin composition containing epoxy resin NICHIBAN COMPANY LIMITED (JP) 2007-08-16 US disclosed
EP-1752494-A1 PHOTO-RADICAL-CURABLE RESIN COMPOSITION CONTAINING EPOXY RESIN Nichiban Company Limited (JP) 2007-02-14 EP disclosed
EP-0923924-B1 Dental adhesive kit SUN MEDICAL CO LTD (JP) 2005-03-09 EP disclosed
US-6288138-B1 Dental adhesive kit SUN MEDICAL CO., LTD. (JP) 2001-09-11 US disclosed
EP-0923924-A2 Dental adhesive kit SUN MEDICAL CO., LTD. (JP) 1999-06-23 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 (3 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-20090258966-A1 Dental Composition DCPS, MMAB, CAD ALDH1A1 1892/4885CYP2A6 4393/4885DRD2 1258/4885
US-20120213832-A1 REMOVABLE DENTAL CURABLE COMPOSITION SMARCA5, SMARCA1, SMARCA2 ALDH1A1 1369/4885CYP2A6 2739/4885DRD2 698/4885
US-20090137697-A1 Dental Curable Composition and Kit for Such Dental Curable Composition SETDB1, SETD1B, SETD2 ALDH1A1 1260/4885CYP2A6 4040/4885DRD2 991/4885

“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.