SCHEMBL7987182

SCHEMBL7987182

CCOC(=O)C(F)c1ccc(I)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.38
MMP8 P22894 1/20 0.38
PIN1 Q13526 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NPC1 O15118 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
TSHR P16473 1/20 0.36
KYAT1 Q16773 1/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA12 O43570 2/20 0.36
CA9 Q16790 2/20 0.36
LMNA P02545 1/20 0.35
ACACB O00763 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL28224535 0.84 ESR1 (0.52) OPRM1KMT2ATDP1TSHRCA1
SCHEMBL27595607 0.84 MAPT (0.47) MEN1KMT2ATDP1LMNA
SCHEMBL11260308 0.82 LMNA (0.53) MMP8MEN1KMT2ANPC1TDP1
SCHEMBL18610656 0.82 MAPT (0.46) MMP8MEN1KMT2ATDP1TSHR
SCHEMBL2799224 0.82 CA12 (0.50) TDP1TSHRCA1CA2CA12
SCHEMBL2400228 0.81 MMP8 (0.56) MMP8PIN1MEN1KMT2ANPC1
SCHEMBL4290959 0.81 MMP8 (0.56) MMP8PIN1MEN1KMT2ANPC1
SCHEMBL4518771 0.81 SLC6A3 (0.46) KMT2ACA1CA2ACACB
SCHEMBL15030577 0.81 MMP8 (0.51) OPRM1MMP8PIN1MEN1KMT2A
SCHEMBL324209 0.81 MMP8 (0.56) MMP8PIN1MEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109456122-A A kind of water-soluble fertilizer and its preparation process containing amino acid 安丘市天赐生物肥料有限公司 2019-03-12 CN claimed
CN-1174677-C Plant growth regulator 肖振英 2004-11-10 CN claimed
CN-1369204-A Plant growth regulator XIAO ZHENYING (CN) 2002-09-18 CN claimed
CN-109456122-A A kind of water-soluble fertilizer and its preparation process containing amino acid 安丘市天赐生物肥料有限公司 2019-03-12 CN disclosed
CN-109456122-A A kind of water-soluble fertilizer and its preparation process containing amino acid 安丘市天赐生物肥料有限公司 2019-03-12 CN disclosed
CN-1174677-C Plant growth regulator 肖振英 2004-11-10 CN disclosed
CN-1369204-A Plant growth regulator XIAO ZHENYING (CN) 2002-09-18 CN disclosed
US-6291677-B1 FOR TREATING SKIN-RELATED DISEASES, INCLUDING, ACTINIC KERATOSES, ARSENIC KERATOSES, INFLAMMATORY AND NON-INFLAMMATORY ACNE, PSORIASIS, ICHTHYOSES AND KERATINIZATION AND HYPERPROLIFERATIVE DISORDERS OF SKIN ALLERGAN SALES, INC. 2001-09-18 US disclosed