3-Hydroxybenzaldehyde

3-Hydroxybenzaldehyde

SCHEMBL9454352

O=Cc1cccc(O)c1.[NaH]

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNB2 O95067 1/20 0.61
CDK1 P06493 1/20 0.61
CDK4 P11802 1/20 0.61
CCNB1 P14635 1/20 0.61
CCND1 P24385 1/20 0.61
CCNB3 Q8WWL7 1/20 0.61
LCK P06239 2/20 0.56
ALDH1A1 P00352 3/20 0.52
UNG P13051 1/20 0.52
CA12 O43570 1/20 0.50
CA2 P00918 1/20 0.50
LMNA P02545 1/20 0.50
CYP3A4 P08684 1/20 0.50
CA5A P35218 1/20 0.50
CA9 Q16790 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CA14 Q9ULX7 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
SRC P12931 1/20 0.50
FBP1 P09467 1/20 0.50

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
3-Hydroxybenzaldehyde SCHEMBL29381261 0.98
3-Hydroxybenzaldehyde SCHEMBL35726 0.98
3-Hydroxybenzaldehyde SCHEMBL29085774 0.98 CCNB2 (0.63) CCNB2CDK1CDK4CCNB1CCND1
3-Hydroxybenzaldehyde SCHEMBL28730066 0.95 CCNB2 (0.61) CCNB2CDK1CDK4CCNB1CCND1
3-Hydroxybenzaldehyde SCHEMBL31057906 0.95 CCNB2 (0.61) CCNB2CDK1CDK4CCNB1CCND1
3-Hydroxybenzaldehyde SCHEMBL29017504 0.95 CCNB2 (0.61) CCNB2CDK1CDK4CCNB1CCND1
3-Hydroxybenzaldehyde SCHEMBL29155378 0.95 CCNB2 (0.61) CCNB2CDK1CDK4CCNB1CCND1
3-Hydroxybenzaldehyde SCHEMBL27611056 0.93 CCNB2 (0.59) CCNB2CDK1CDK4CCNB1CCND1
3-Hydroxybenzaldehyde SCHEMBL29155415 0.91 ALDH1A1 (0.61) CCNB2CDK1CDK4CCNB1CCND1
3-Hydroxybenzaldehyde SCHEMBL2230842 0.91 CCNB2 (0.57) CCNB2CDK1CDK4CCNB1CCND1

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-5234946-A Anticholesterol, antilipemic BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-08-10 US disclosed
EP-0318860-B1 SUBSTITUTED ALKYLAMINE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-06-16 EP disclosed
CN-1037141-A The alkylamine derivative that replaces BANYU PHARMA CO LTD (JP) 1989-11-15 CN disclosed
EP-0318860-A2 Substituted alkylamine derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1989-06-07 EP disclosed
US-4205188-A CONDENSATION OF PHENOL AND FORMALDEHYDE AND REMOVAL OF EXCESS PHENOL BY SOLVENT EXTRACTION THE DOW CHEMICAL COMPANY (US) 1980-05-27 US disclosed