SCHEMBL30035564

SCHEMBL30035564

Oc1ccccc1C(c1ccccc1)(c1ccccc1)c1ccccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.52
▸ TSHR P16473 4/20 0.52
▸ TDP1 Q9NUW8 3/20 0.52
▸ CA2 P00918 4/20 0.43
▸ CA4 P22748 4/20 0.43
▸ HPGD P15428 4/20 0.43
▸ HSD17B10 Q99714 3/20 0.43
▸ CA12 O43570 3/20 0.43
▸ CA14 Q9ULX7 3/20 0.43
▸ ALOX15 P16050 3/20 0.43
▸ CYP3A4 P08684 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ CA3 P07451 2/20 0.43
▸ HIF1A Q16665 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ GMNN O75496 1/20 0.43
▸ EGFR P00533 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ FYN P06241 1/20 0.43

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
SCHEMBL584286 1.00 ALDH1A1 (0.52) ALDH1A1TSHRTDP1CA2CA4
SCHEMBL7161191 0.95 ALDH1A1 (0.52) ALDH1A1TSHRTDP1CA2CA4
SCHEMBL31205557 0.95 ALDH1A1 (0.52) ALDH1A1TSHRTDP1CA2CA4
SCHEMBL384048 0.95 ALDH1A1 (0.52) ALDH1A1TSHRTDP1CA2CA4
Ammonia Solution, Strong SCHEMBL31387947 0.93 ALDH1A1 (0.50) ALDH1A1TSHRTDP1CA2CA4
SCHEMBL30717192 0.93 ALDH1A1 (0.50) ALDH1A1TSHRTDP1CA2CA4
SCHEMBL8524899 0.91 ESR1 (0.52) ALDH1A1TSHRTDP1CA2CA4
SCHEMBL28141477 0.88 ALDH1A1 (0.47) ALDH1A1TSHRTDP1CA2CA4
SCHEMBL6685287 0.87 ESR1 (0.52) ALDH1A1TSHRTDP1CA2CA4
SCHEMBL23861613 0.84 TSHR (0.45) ALDH1A1TSHRTDP1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115181260-B Modified epoxy resin for water-based heavy-duty anticorrosive paint and preparation method thereof 广东腐蚀科学与技术创新研究院 2022-12-20 — — CN claimed
CN-115181260-A Modified epoxy resin for water-based heavy-duty anticorrosive paint and preparation method thereof 广东腐蚀科学与技术创新研究院 2022-10-14 — — CN claimed
CN-113563582-B Fluorine-free and silicon-free low-surface-energy material and preparation method thereof 江苏斯迪克新材料科技股份有限公司 2023-08-25 — — CN disclosed
CN-115181260-B Modified epoxy resin for water-based heavy-duty anticorrosive paint and preparation method thereof 广东腐蚀科学与技术创新研究院 2022-12-20 — — CN disclosed
CN-115181260-A Modified epoxy resin for water-based heavy-duty anticorrosive paint and preparation method thereof 广东腐蚀科学与技术创新研究院 2022-10-14 — — CN disclosed
Send feedback