SCHEMBL7056637

SCHEMBL7056637

Cc1c(C)c2c(c(C)c1OCc1ccccc1)CCC(C)(CCO)O2

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 5/20 0.47
ALOX5 P09917 2/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
PDE4A P27815 1/20 0.41
PDE3A Q14432 1/20 0.41
GSTO1 P78417 2/20 0.41
PTPN1 P18031 1/20 0.41
NR1I2 O75469 1/20 0.40
MAPT P10636 2/20 0.39
LMNA P02545 2/20 0.39
GSTP1 P09211 1/20 0.39
TTPA P49638 1/20 0.39
USP2 O75604 1/20 0.39
THRB P10828 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL11446496 1.00 PSEN1 (0.47) PSEN1ALOX5MEN1KMT2APDE4A
SCHEMBL11446495 1.00 PSEN1 (0.47) PSEN1ALOX5MEN1KMT2APDE4A
Methane SCHEMBL11453290 0.99 PSEN1 (0.46) PSEN1ALOX5MEN1KMT2APDE4A
Methane SCHEMBL11453288 0.99 PSEN1 (0.46) PSEN1ALOX5MEN1KMT2APDE4A
SCHEMBL11445900 0.94 PSEN1 (0.45) PSEN1ALOX5MEN1KMT2APDE4A
SCHEMBL11445899 0.94 PSEN1 (0.45) PSEN1ALOX5MEN1KMT2APDE4A
SCHEMBL29670864 0.91 PSEN1 (0.44) PSEN1ALOX5MEN1KMT2APDE4A
SCHEMBL11440561 0.91 PSEN1 (0.44) PSEN1ALOX5MEN1KMT2APDE4A
SCHEMBL11440558 0.91 PSEN1 (0.44) PSEN1ALOX5MEN1KMT2APDE4A
SCHEMBL7843126 0.91 PSEN1 (0.44) PSEN1ALOX5MEN1KMT2APDE4A

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0799219-B1 ESTERS AND AMIDES OF NON-STEROIDAL ANTI-INFLAMMATORY CARBOXYLIC ACIDS WHICH MAY BE USED AS ANTI-OXIDANTS, 5-LIPOXYGENASE INHIBITORS AND NON-STEROIDAL ANTI-INFLAMMATORY PRODUCTS ALCON LAB INC (US) 2003-05-07 EP disclosed
US-6200990-B1 4-PHENYLPIPERIDIN-1-YLETHANOL DERIVATIVES; VISION DEFECTS, BRAIN AND SPINAL CORD INJURIES ALCON LABORATORIES, INC. 2001-03-13 US disclosed
US-5811438-A USEFUL FOR PREVENTING OR ALLEVIATING TISSUE EDEMA, CONJUNCTIVA SWELLING AND CONGESTION OR CORNEAL HAZE ALCON LABORATORIES, INC. (US) 1998-09-22 US disclosed
US-5798356-A FOR PREVENTION OF PATHOLOGICAL NEOVASCULARIZATION ALCON LABORATORIES, INC. (US) 1998-08-25 US disclosed
US-5719167-A BENZOFURAN OR CHROMAN COMPOUND ALCON LABORATORIES, INC. (US) 1998-02-17 US disclosed
WO-1997041852-A1 ANGIOSTATIC COMPOUNDS ALCON LABORATORIES, INC. (US) 1997-11-13 WO disclosed
WO-1997041844-A1 COMBINATIONS OF ANGIOSTATIC COMPOUNDS ALCON LABORATORIES, INC. (US) 1997-11-13 WO disclosed
EP-0799219-A2 ESTERS AND AMIDES OF NON-STEROIDAL ANTI-INFLAMMATORY CARBOXYLIC ACIDS WHICH MAY BE USED AS ANTI-OXIDANTS, 5-LIPOXYGENASE INHIBITORS AND NON-STEROIDAL ANTI-INFLAMMATORY PRODUCTS ALCON LABORATORIES, INC. (US) 1997-10-08 EP disclosed
US-5643943-A NONSTEROIDAL ANTIINFLAMMATORY AGENTS FOR VASCULAR INFLAMMATION ALCON LABORATORIES, INC. (US) 1997-07-01 US disclosed
US-5607966-A BENZOFURAN OR BENZOPYRAN DERIVATIVES ALCON LABORATORIES, INC. (US) 1997-03-04 US disclosed
EP-0139421-B1 THIAZOLIDINE DERIVATIVES, THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM SANKYO COMPANY LIMITED (JP) 1988-04-27 EP disclosed
US-4572912-A Thiazolidine derivatives, their preparation and compositions containing them SANKYO COMPANY LIMITED (JP) 1986-02-25 US disclosed
EP-0139421-A1 Thiazolidine derivatives, their preparation and compositions containing them SANKYO COMPANY LIMITED (JP) 1985-05-02 EP disclosed
US-4191842-A Protected alcohols HOFFMANN-LA ROCHE INC. (US) 1980-03-04 US disclosed
US-4151205-A Synthesis of vitamin E HOFFMAN-LA ROCHE INC. (US) 1979-04-24 US disclosed
US-4051153-A Intermediates in the synthesis of vitamin E HOFFMANN-LA ROCHE INC. (US) 1977-09-27 US disclosed
US-4026907-A INTERMEDIATES FOR ALPHA-TOCOPHEROL HOFFMANN-LA ROCHE INC. (US) 1977-05-31 US disclosed
US-4018799-A INTERMEDIATES FOR TOCOPHEROL HOFFMANN-LA ROCHE INC. (US) 1977-04-19 US disclosed
US-4003919-A INTERMEDIATES FOR ALPHA-TOCOPHEROL HOFFMANN-LA ROCHE INC. (US) 1977-01-18 US disclosed
US-3947473-A (6-HYDROXY-CHROMAN-2-YL) CARBOXYLIC ACID DERIVATIVES HOFFMAN-LA ROCHE INC. (US) 1976-03-30 US disclosed