SCHEMBL498650

SCHEMBL498650

c1ccc(-c2ccc(-c3ccccc3)s2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 3/20 0.65
HSD17B2 P37059 3/20 0.65
CYP2E1 P05181 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2A6 P11509 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2B6 P20813 1/20 0.58
CYP2C19 P33261 1/20 0.58
NQO2 P16083 3/20 0.58
RAB9A P51151 3/20 0.54
MEN1 O00255 1/20 0.54
POLB P06746 1/20 0.54
KMT2A Q03164 1/20 0.54
APP P05067 3/20 0.52
ESR1 P03372 1/20 0.52
ESR2 Q92731 1/20 0.52
HDAC1 Q13547 1/20 0.52
ALDH1A1 P00352 2/20 0.50
NPC1 O15118 2/20 0.48
KDM4E B2RXH2 1/20 0.48

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
SCHEMBL14190035 0.97 HSD17B1 (0.62) HSD17B1HSD17B2CYP2E1CYP3A4CYP2A6
SCHEMBL2242666 0.97 HSD17B1 (0.62) HSD17B1HSD17B2CYP2E1CYP3A4CYP2A6
SCHEMBL7587610 0.97 HSD17B1 (0.62) HSD17B1HSD17B2CYP2E1CYP3A4CYP2A6
SCHEMBL7587868 0.97 HSD17B1 (0.62) HSD17B1HSD17B2CYP2E1CYP3A4CYP2A6
SCHEMBL2241368 0.97 HSD17B1 (0.62) HSD17B1HSD17B2CYP2E1CYP3A4CYP2A6
SCHEMBL7591649 0.97 HSD17B1 (0.62) HSD17B1HSD17B2CYP2E1CYP3A4CYP2A6
SCHEMBL2240182 0.97 HSD17B1 (0.62) HSD17B1HSD17B2CYP2E1CYP3A4CYP2A6
SCHEMBL12562751 0.94 MEN1 (0.61) HSD17B1HSD17B2CYP2E1CYP3A4CYP2A6
SCHEMBL14190049 0.94 MEN1 (0.61) HSD17B1HSD17B2CYP2E1CYP3A4CYP2A6
SCHEMBL560206 0.94 MEN1 (0.61) HSD17B1HSD17B2CYP2E1CYP3A4CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12358871-B2 Photochemical synthesis of vitamin D3 using sensitizers FERMENTA BIOTECH LIMITED (IN) 2025-07-15 US claimed
CN-118561808-A Preparation method of 2, 5-diphenyl thiophene 石河子大学 2024-08-30 CN claimed
CN-117486854-A One-pot method for preparing 2, 5-diaryl substituted thiophene 浙江大学 2024-02-02 CN claimed
CN-116813853-A Sulfonated phenylene polymer and preparation method and application thereof 南方科技大学 2023-09-29 CN claimed
CN-116606304-A High-charge-density organic semiconductor molecule and preparation method and application thereof 天津大学 2023-08-18 CN claimed
US-20220372065-A1 SYNTHESIS OF CHOLESTEROL AND VITAMIN D3 FROM PHYTOSTEROLS FERMENTA BIOTECH LIMITED (IN) 2022-11-24 US claimed
US-20220298106-A1 IMPROVED PHOTOCHEMICAL SYNTHESIS OF VITAMIN D3 USING SENSITIZERS FERMENTA BIOTECH LIMITED (IN) 2022-09-22 US claimed
EP-3906247-A1 SYNTHESIS OF CHOLESTEROL AND VITAMIN D3 FROM PHYTOSTEROLS Fermenta Biotech Limited (IN) 2021-11-10 EP claimed
EP-3906227-A1 IMPROVED PHOTOCHEMICAL SYNTHESIS OF VITAMIN D3 USING SENSITIZERS Fermenta Biotech Limited (IN) 2021-11-10 EP claimed
WO-2021005618-A1 SYNTHESIS OF CHOLESTEROL AND VITAMIN D3 FROM PHYTOSTEROLS FERMENTA BIOTECH LIMITED (IN) 2021-01-14 WO claimed
WO-2020230169-A1 IMPROVED PHOTOCHEMICAL SYNTHESIS OF VITAMIN D3 USING SENSITIZERS FERMENTA BIOTECH LIMITED (IN) 2020-11-19 WO claimed
CN-111926389-A Bipolar organic single crystal grown by molecular blending, preparation method and application thereof 吉林大学 2020-11-13 CN claimed
CN-102972401-B 2, 5-diphenylthiophene nano microcapsule preparation for preventing lygocoris lucorum and method for preparing 2, 5-diphenylthiophene nano microcapsule preparation for preventing lygocoris lucorum UNIV YANGZHOU 2014-11-05 CN claimed
CN-102972401-A 2, 5-diphenylthiophene nano microcapsule preparation for preventing lygocoris lucorum and method for preparing 2, 5-diphenylthiophene nano microcapsule preparation for preventing lygocoris lucorum UNIV YANGZHOU 2013-03-20 CN claimed
US-8029970-B2 Composition for manufacturing barrier rib, and plasma display panel manufactured by the same SAMSUNG SDI CO., LTD. (KR) 2011-10-04 US claimed
US-20080290314-A1 COMPOSITION FOR MANUFACTURING BARRIER RIB, AND PLASMA DISPLAY PANEL MANUFACTURED BY THE SAME SAMSUNG SDI CO., LTD. (KR) 2008-11-27 US claimed
EP-0360618-B1 LIGHT-SENSITIVE COMPOSITION FUJI PHOTO FILM CO., LTD. (JP) 1992-12-16 EP claimed
EP-0318066-B1 ARYL-SUBSTITUTED THIOPHENE 3-OLS, DERIVATIVES AND ANALOGS, AS LIPOXYGENASE INHIBITORS MERCK & CO. INC. (US) 1992-07-29 EP claimed
EP-0318066-A1 Aryl-substituted thiophene 3-ols, derivatives and analogs, as lipoxygenase inhibitors MERCK & CO. INC. (US) 1989-05-31 EP claimed
US-4174405-A MITICIDES UNIROYAL, INC. (US) 1979-11-13 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20220372065-A1 SYNTHESIS OF CHOLESTEROL AND VITAMIN D3 FROM PHYTOSTEROLS CYP2R1, CYP46A1, CYP24A1 HSD17B1 36/4885HSD17B2 50/4885CYP2E1 382/4885
US-12358871-B2 Photochemical synthesis of vitamin D3 using sensitizers CYP2R1, CYP24A1, VDR HSD17B1 33/4885HSD17B2 38/4885CYP2E1 112/4885
US-20220298106-A1 IMPROVED PHOTOCHEMICAL SYNTHESIS OF VITAMIN D3 USING SENSITIZERS CYP2R1, CYP24A1, CYP27B1 HSD17B1 30/4885HSD17B2 34/4885CYP2E1 120/4885

“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.