Anisaldehyde

Anisaldehyde

SCHEMBL6586624

COc1ccc(C=O)cc1.c1cc2cc(c1)OC2

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
CYP2A6 P11509 1/20 0.54
TDP1 Q9NUW8 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
DYRK1A Q13627 3/20 0.40
DYRK1B Q9Y463 3/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 2/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
RELA Q04206 4/20 0.40
CLK1 P49759 2/20 0.39
MAOB P27338 2/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NFE2L2 Q16236 2/20 0.37
APP P05067 1/20 0.37
TRPA1 O75762 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
SCHEMBL28015413 0.86 RELA (0.40) ALDH1A1CYP2A6DYRK1ADYRK1BMAPT
SCHEMBL5136658 0.81 ALDH1A1 (0.43) ALDH1A1NPC1RAB9AMAPTLMNA
4-Hydroxybenzaldehyde SCHEMBL6942477 0.81 ALDH5A1 (0.50) ALDH1A1TDP1RAB9AMAPTMAOB
P-Anisic Acid SCHEMBL3469544 0.79 CA1 (0.56) ALDH1A1NPC1RAB9ARELAMEN1
SCHEMBL28168223 0.78 APP (0.49) ALDH1A1TDP1NPC1RAB9AMAPT
P-Anisic Acid SCHEMBL6586497 0.78 CA1 (0.54) ALDH1A1NPC1RAB9ARELAMEN1
2-Methoxybenzaldehyde SCHEMBL5687915 0.77 ERN1 (0.46) ALDH1A1TDP1NPC1RAB9ALMNA
3-Hydroxybenzaldehyde SCHEMBL9842145 0.77 CCNB2 (0.42) ALDH1A1MAPTMAOBMEN1KMT2A
SCHEMBL9240143 0.76 ALDH1A1 (0.40) ALDH1A1NPC1RAB9AMAPTLMNA
SCHEMBL27694314 0.76 JAK2 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0674232-B1 Recording sheets XEROX CORP (US) 2000-05-31 EP claimed
US-5931995-A Ink compositions XEROX CORPORATION (US) 1999-08-03 US claimed
US-5663022-A Recording sheets XEROX CORPORATION (US) 1997-09-02 US claimed
EP-0674232-A2 Recording sheets XEROX CORPORATION (US) 1995-09-27 EP claimed
CN-103242281-A 3'-hydroxy-4',5,6,7-tetramethoxy isoflavanone and preparation method thereof UNIV DONGHUA 2013-08-14 CN disclosed
US-20040043999-A1 Phthalazine derivatives as phosphodiesterase 4-inhibitors ZAMBON GROUP S.P.A 2004-03-04 US disclosed
EP-1042300-B1 PHTHALAZINE DERIVATIVES USEFUL AS PHOSPHODIESTERASE 4 INHIBITORS ZAMBON SPA (IT) 2004-02-11 EP disclosed
US-6589951-B1 N right-arrowO derivatives and pharmaceutically acceptable salt thereof are PDE 4 and TNF pharmaceutically acceptable salt thereof are PDE 4 and TNF alpha inhibitors. ZAMBON GROUP S.P.A. (IT) 2003-07-08 US disclosed
US-20020049322-A1 Quinoline and quinazoline compounds useful in therapy COLLIS ALAN JOHN (GB) 2002-04-25 US disclosed
EP-1042300-A1 PHTHALAZINE DERIVATIVES PHOSPHODIESTERASE 4 INHIBITORS ZAMBON GROUP S.p.A. (IT) 2000-10-11 EP disclosed
US-6017385-A Ink compositions XEROX CORPORATION (US) 2000-01-25 US disclosed
US-5931995-A Ink compositions XEROX CORPORATION (US) 1999-08-03 US disclosed
WO-1999032456-A1 PHTHALAZINE DERIVATIVES PHOSPHODIESTERASE 4 INHIBITORS ZAMBON GROUP S.P.A. (IT) 1999-07-01 WO disclosed
EP-0183216-B1 N-(ARALKOXYBENZYL)-4(BENZHYDRYL) PIPERIDINES G.D. Searle & Co. (US) 1989-07-19 EP disclosed
US-4650874-A CARDIOVASCULAR AGENTS G. D. SEARLE & CO. (US) 1987-03-17 US disclosed
EP-0183216-A1 N-(Aralkoxybenzyl)-4(benzhydryl) piperidines G.D. Searle & Co. (US) 1986-06-04 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 (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-20020049322-A1 Quinoline and quinazoline compounds useful in therapy NQO2, RFT1, IDH3B ALDH1A1 514/4885CYP2A6 236/4885TDP1 2296/4885
US-20040043999-A1 Phthalazine derivatives as phosphodiesterase 4-inhibitors PDE5A, PDE3B, PDE3A ALDH1A1 780/4885CYP2A6 430/4885TDP1 159/4885

“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.