SCHEMBL3844741

SCHEMBL3844741

O=C(O)C(=O)Cc1ncc[nH]1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.50
GAA P10253 5/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TAAR1 Q96RJ0 5/20 0.44
HTT P42858 4/20 0.43
KDM4E B2RXH2 3/20 0.43
FDPS P14324 1/20 0.43
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALOX15 P16050 1/20 0.41
FPR2 P25090 1/20 0.39
HTR1A P08908 1/20 0.39
TERT O14746 1/20 0.38

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
Hydrochloric Acid SCHEMBL3184145 0.98 TBXAS1 (0.51) TBXAS1GAASMN1; SMN2TAAR1HTT
Phosphoric Acid SCHEMBL28987144 0.93 FDPS (0.50) TBXAS1GAASMN1; SMN2TAAR1HTT
SCHEMBL9694649 0.87 TBXAS1 (0.41) TBXAS1GAASMN1; SMN2TAAR1HTT
Imidazoleacetic Acid SCHEMBL360337 0.83
Imidazoleacetic Acid SCHEMBL2172193 0.82 TBXAS1 (0.59) TBXAS1GAASMN1; SMN2TAAR1HTT
Imidazoleacetic Acid SCHEMBL15007471 0.82 TBXAS1 (0.56) TBXAS1GAASMN1; SMN2TAAR1HTT
Imidazoleacetic Acid SCHEMBL17375738 0.82 TBXAS1 (0.56) TBXAS1GAASMN1; SMN2TAAR1HTT
SCHEMBL8519473 0.81 TBXAS1 (0.50) TBXAS1GAASMN1; SMN2TAAR1HTT
SCHEMBL14321816 0.81 TBXAS1 (0.47) TBXAS1GAASMN1; SMN2TAAR1HTT
Imidazoleacetic Acid SCHEMBL2827600 0.80 TBXAS1 (0.54) TBXAS1GAASMN1; SMN2TAAR1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113733262-A Surface dipping wear-resistant treatment process for environment-friendly plate 雪宝家居集团有限公司 2021-12-03 CN claimed
CN-100355737-C Pyruvic acid type ionic liquid and its preparing method UNIV EAST CHINA NORMAL (CN) 2007-12-19 CN claimed
CN-1821228-A Pyruvic acid type ionic liquid and its preparing method UNIV EAST CHINA NORMAL (CN) 2006-08-23 CN claimed
US-5995869-A Reduction of skin sensitization in electrotransport drug delivery ALZA CORPORATION (US) 1999-11-30 US claimed
US-5912010-A ADMINISTERING LOOP DIURETIC ALONE OR WITH MAST CELL DEGRANULATOR OR GLUCOCORTICOSTEROID E.R. SQUIBB & SONS, INC. (US) 1999-06-15 US claimed
US-5843979-A Transdermal treatment with mast cell degranulating agents for drug-induced hypersensitivity BRISTOL-MYERS SQUIBB COMPANY (US) 1998-12-01 US claimed
WO-1997047355-A1 REDUCTION OF SKIN SENSITIZATION IN ELECTROTRANSPORT DRUG DELIVERY ALZA CORPORATION (US) 1997-12-18 WO claimed
US-5686100-A Prophylactic and therapeutic treatment of skin sensitization and irritation E.R. SQUIBB & SONS, INC. (US) 1997-11-11 US claimed
EP-0612525-A1 Transdermal treatment with mast cell degranulating agents for drug-induced hypersensitivity BRISTOL-MYERS SQUIBB COMPANY (US) 1994-08-31 EP claimed
JP-61293393-A None JP disclosed
US-12201595-B2 Compositions and methods for increasing muscle mass and strength, treating skin, reducing wear and degradation from aging and exposure and improving recovery from stress such as exercise and trauma CALWOOD NUTRITIONALS, LLC (US) 2025-01-21 US disclosed
US-20220175708-A1 COMPOSITIONS AND METHODS FOR INCREASING MUSCLE MASS AND STRENGTH, TREATING SKIN, REDUCING WEAR AND DEGRADATION FROM AGING AND EXPOSURE AND IMPROVING RECOVERY FROM STRESS SUCH AS EXERCISE AND TRAUMA CALWOOD NUTRITIONALS, LLC (US) 2022-06-09 US disclosed
US-11285124-B2 Compositions and methods for increasing muscle mass and strength, treating skin, reducing wear and degradation from aging and exposure and improving recovery from stress such as exercise and trauma CALWOOD NUTRITIONALS, LLC (US) 2022-03-29 US disclosed
CN-113733262-A Surface dipping wear-resistant treatment process for environment-friendly plate 雪宝家居集团有限公司 2021-12-03 CN disclosed
US-4859591-A Transamination process for producing amino acids W. R. GRACE & CO.-CONN. (US) 1989-08-22 US disclosed
EP-0120208-B1 MICROBIOLOGICALLY PRODUCED L-PHENYLALANIN-DEHYDROGENASE, PROCESS FOR OBTAINING IT AND ITS USE Degussa Aktiengesellschaft (DE) 1989-03-22 EP disclosed
JP-S61293393-A DNA BASE SEQUENCE AND PRODUCTION OF AMINO ACID USING SAID SEQUENCE MITSUI TOATSU CHEM INC 1986-12-24 JP disclosed
US-4590161-A AEROBIC CULTIVATION OF BREUIBACTERIUM DEGUSSA AKTIENGESELLSCHAFT (DE) 1986-05-20 US disclosed
EP-0120208-A2 Microbiologically produced L-phenylalanin-dehydrogenase, process for obtaining it and its use Degussa Aktiengesellschaft (DE) 1984-10-03 EP disclosed
US-4100161-A Promotion of protein synthesis and suppression of urea formation in the body by keto analogs of essential amino acids THE JOHNS HOPKINS UNIVERSITY (US) 1978-07-11 US disclosed