SCHEMBL7563544

SCHEMBL7563544

CCCCCN(CC)CCO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
HPGD P15428 1/20 0.48
MAPK1 P28482 1/20 0.48
HIF1A Q16665 1/20 0.48
KCNH2 Q12809 5/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 1/20 0.43
KDM5A P29375 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
DNM1 Q05193 3/20 0.40
PLA2G1B P04054 1/20 0.39
PLA2G2A P14555 1/20 0.39
MGLL Q99685 1/20 0.38
CA12 O43570 1/20 0.37

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
SCHEMBL22242828 0.98 KCNH2 (0.48) HSD17B10CYP1A2CYP2C9HPGDMAPK1
SCHEMBL27511565 0.98 KCNH2 (0.48) HSD17B10CYP1A2CYP2C9HPGDMAPK1
SCHEMBL4452042 0.98 KCNH2 (0.48) HSD17B10CYP1A2CYP2C9HPGDMAPK1
SCHEMBL1404105 0.98 KCNH2 (0.48) HSD17B10CYP1A2CYP2C9HPGDMAPK1
SCHEMBL8750318 0.98 KCNH2 (0.48) HSD17B10CYP1A2CYP2C9HPGDMAPK1
Ammonia Solution, Strong SCHEMBL6253711 0.98 HSD17B10 (0.47) HSD17B10CYP1A2CYP2C9HPGDMAPK1
SCHEMBL465391 0.98 KCNH2 (0.48) HSD17B10CYP1A2CYP2C9HPGDMAPK1
SCHEMBL1532514 0.98 KCNH2 (0.48) HSD17B10CYP1A2CYP2C9HPGDMAPK1
Hydrochloric Acid SCHEMBL27703679 0.95 KCNH2 (0.47) HSD17B10CYP1A2CYP2C9HPGDMAPK1
Hydrochloric Acid SCHEMBL28013071 0.95 KCNH2 (0.47) HSD17B10CYP1A2CYP2C9HPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10647677-B2 Analogues of hydroxychloroquine (HCQ) without retinal toxicity INOVIEM SCIENTIFIC (FR) 2020-05-12 US disclosed
EP-2860170-B1 PROCESS FOR PREPARING 4-HYDROXYBUTYL ACRYLATE OSAKA ORGANIC CHEMICAL IND LTD (JP) 2019-08-28 EP disclosed
WO-2019155016-A1 VIRAL VECTOR TRANSDUCTION OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2019-08-15 WO disclosed
EP-3015449-B1 (METH)ACRYLATE PRODUCTION SYSTEM OSAKA ORGANIC CHEMICAL IND LTD (JP) 2018-10-10 EP disclosed
CN-105339341-B Production system for (meth) acrylic acid ester 大阪有机化学工业株式会社 2018-02-13 CN disclosed
US-9670129-B2 Process for preparing 4-hydroxybutyl acrylate OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) 2017-06-06 US disclosed
US-20160136538-A1 (METH)ACRYLATE PRODUCTION SYSTEM OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) 2016-05-19 US disclosed
EP-3015449-A1 (METH)ACRYLATE PRODUCTION SYSTEM Osaka Organic Chemical Ind., Ltd. (JP) 2016-05-04 EP disclosed
CN-105339341-A Production system for (meth) acrylic acid ester OSAKA ORGANIC CHEM IND 2016-02-17 CN disclosed
US-20150126766-A1 PROCESS FOR PREPARING 4-HYDROXYBUTYL ACRYLATE OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) 2015-05-07 US disclosed
EP-2860170-A1 PROCESS FOR PREPARING 4-HYDROXYBUTYL ACRYLATE Osaka Organic Chemical Ind., Ltd. (JP) 2015-04-15 EP disclosed
CN-104220413-A Method for producing 4-hydroxybutyl acrylate OSAKA ORGANIC CHEM IND 2014-12-17 CN disclosed
EP-0906902-B1 A method for the production of an alkylamino (meth)acrylate and apparatus therefor. NIPPON CATALYTIC CHEM IND (JP) 2002-08-28 EP disclosed
US-6417392-B1 CATALYTIC ESTER INTERCHANGE OF ALKYL (METH)ACRYLATE AND ALKYLAMINO ALCOHOL; DISTILLATION OF ALKYL ALCOHOL BY-PRODUCT IN AZEOTROPIC MIXTURE WITH ALKYL (METH)ACRYLATE; PURIFICATION USING ION EXCHANGE RESIN NIPPON SHOKUBAI CO., LTD. (JP) 2002-07-09 US disclosed
EP-0906902-A2 A method for the production of an alkylamino (meth)acrylate and apparatus therefor. NIPPON SHOKUBAI CO., LTD. (JP) 1999-04-07 EP 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 (2 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-10647677-B2 Analogues of hydroxychloroquine (HCQ) without retinal toxicity SSB, UACA, XPA HSD17B10 1229/4885CYP1A2 1963/4885CYP2C9 486/4885
US-20150126766-A1 PROCESS FOR PREPARING 4-HYDROXYBUTYL ACRYLATE LTB4R2, LTA4H, LTB4R HSD17B10 16/4885CYP1A2 123/4885CYP2C9 157/4885

“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.