SCHEMBL400497

SCHEMBL400497

CC(=O)c1ccc(C#Cc2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
HPGD P15428 2/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
GRM5 P41594 2/20 0.53
APP P05067 1/20 0.52
FFAR1 O14842 4/20 0.52
VCP P55072 1/20 0.52
MMP2 P08253 1/20 0.51
MMP9 P14780 1/20 0.51
MMP12 P39900 1/20 0.51
MMP14 P50281 1/20 0.51
MMP15 P51511 1/20 0.51
MMP16 P51512 1/20 0.51
MMP26 Q9NRE1 1/20 0.51
MAOB P27338 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
TAAR1 Q96RJ0 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
SCHEMBL7732264 0.94 MAPT (0.70) MAPTSMN1; SMN2HPGDALDH1A1LMNA
SCHEMBL15960257 0.87 RARB (0.63) MAPTSMN1; SMN2HPGDALDH1A1LMNA
SCHEMBL28933332 0.87 HPGD (0.50) MAPTSMN1; SMN2HPGDALDH1A1LMNA
SCHEMBL24808421 0.84 VCP (0.74) MAPTSMN1; SMN2HPGDALDH1A1LMNA
SCHEMBL7739110 0.84 ASIC3 (0.62) MAPTSMN1; SMN2HPGDALDH1A1GRM5
SCHEMBL10411946 0.82 ACACB (0.49) MAPTSMN1; SMN2HPGDALDH1A1LMNA
SCHEMBL3753633 0.82 CES2 (0.64) MAPTGRM5APPFFAR1VCP
SCHEMBL402518 0.82 RARB (0.62) GRM5APPFFAR1MMP2MMP9
SCHEMBL12182347 0.82 ACACB (0.57) MAPTSMN1; SMN2HPGDALDH1A1APP
SCHEMBL28950553 0.81 MAPT (0.47) MAPTSMN1; SMN2HPGDALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4554797-A1 ANTI-COUNTERFEITING LABEL FOR THE AUTHENTICATION OF GOODS Politecnico di Milano (IT) 2025-05-21 EP claimed
WO-2024013693-A1 ANTI-COUNTERFEITING LABEL FOR THE AUTHENTICATION OF GOODS POLITECNICO DI MILANO (IT) 2024-01-18 WO claimed
EP-0744391-B1 Process for the preparation of aromatic acetyles using palladacyclen as acatalysts AVENTIS RES & TECH GMBH & CO (DE) 2001-09-26 EP claimed
EP-4570317-A2 COMPOUNDS FOR THE TREATMENT OF BOVINE OR SWINE RESPIRATORY DISEASE Intervet International B.V. (NL) 2025-06-18 EP disclosed
US-12227485-B2 Compounds useful for the treatment of infection with Mannheimia haemolytica or Histophilus somni INTERVET INC. (US) 2025-02-18 US disclosed
CN-113825735-B Carbon-carbon bond formation method 奥加诺株式会社 2025-01-07 CN disclosed
US-12157717-B2 Compounds for the treatment of bovine or swine respiratory disease INTERVET INC. (US) 2024-12-03 US disclosed
US-12077488-B2 Compounds useful for treating a Mannheimia haemolytica or Histophilus somni infection INTERVET INC. (US) 2024-09-03 US disclosed
CN-117466695-A Cobalt-catalyzed alkyne synthesis method 合肥工业大学 2024-01-30 CN disclosed
US-20230232826-A1 USE OF 4-(PHENYLETHYNYL) BENZOIC ACID CHINA JILIANG UNIVERSITY (CN) 2023-07-27 US disclosed
CN-110072844-B Compounds for the treatment of infection by Mannheimia haemolytica or histophilus somni 英特维特国际股份有限公司 2023-06-02 CN disclosed
WO-2003082272-A1 SUBSTITUTED BENZAZOLES AND USE THEREOF AS RAF KINASE INHIBITORS CHIRON CORPORATION (US) 2003-10-09 WO disclosed
EP-0729465-B1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE DAVIS & CO (US) 2003-01-22 EP disclosed
US-6005103-A TREATMENT OF BACTERIAL AND VIRAL INFECTIONS AND DISEASES, INCLUDING AIDS WARNER-LAMBERT COMPANY (US) 1999-12-21 US disclosed
US-5886240-A Process for preparing aromatic acetylenes using palladacycles as catalysts HOECHST AKTIENGESELLSCHAFT (DE) 1999-03-23 US disclosed
US-5808062-A AIDS THERAPY WARNER-LAMBERT COMPANY (US) 1998-09-15 US disclosed
US-5723573-A ACETYLENIC END GROUPS HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-03-03 US disclosed
EP-0729466-A1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1996-09-04 EP disclosed
WO-1995014014-A2 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1995-05-26 WO disclosed
US-5185363-A Administering for treatment of inflammatory diseases ABBOTT LABORATORIES (US) 1993-02-09 US 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 (4 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-12077488-B2 Compounds useful for treating a Mannheimia haemolytica or Histophilus somni infection SORD, HEXD, SNRPD1 MAPT 3738/4885SMN1; SMN2 2241/4885HPGD 28/4885
US-20230232826-A1 USE OF 4-(PHENYLETHYNYL) BENZOIC ACID BOLA2; BOLA2B, BCL2L10, EIF4G1 MAPT 4638/4885SMN1; SMN2 4816/4885HPGD 4196/4885
US-12227485-B2 Compounds useful for the treatment of infection with Mannheimia haemolytica or Histophilus somni SORD, HEXD, SNRPD1 MAPT 4017/4885SMN1; SMN2 2033/4885HPGD 37/4885
US-12157717-B2 Compounds for the treatment of bovine or swine respiratory disease PIGS, BTD, PPARD MAPT 2194/4885SMN1; SMN2 2513/4885HPGD 150/4885

“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.