SCHEMBL17036668

SCHEMBL17036668

CCCC(=O)OCCCNC(C)C

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.44
HRH3 Q9Y5N1 1/20 0.42
ADRB2 P07550 1/20 0.41
NAAA Q02083 1/20 0.40
HTR2C P28335 1/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 1/20 0.40
EPHX2 P34913 1/20 0.40
MAPT P10636 1/20 0.39
FAAH O00519 1/20 0.38
DNM1 Q05193 1/20 0.38

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
SCHEMBL22965627 0.89 DGKA (0.42) DGKAHTR2CALDH1A1KDM4ETDP1
SCHEMBL11190223 0.87 DGKA (0.50) DGKANAAAHTR2CALDH1A1LMNA
SCHEMBL17039296 0.79 DGKA (0.48) DGKANAAAHTR2CALDH1A1LMNA
SCHEMBL8924852 0.79 EPHX2 (0.38) DGKAHRH3ADRB2ALDH1A1KDM4E
SCHEMBL5930623 0.78 DGKA (0.60) DGKANAAAHTR2CALDH1A1MAPT
SCHEMBL421653 0.78 NAAA (0.60) DGKANAAAHTR2CALDH1A1EPHX2
SCHEMBL12176701 0.78 CYP1A2 (0.52) ALDH1A1
SCHEMBL27847936 0.77 ALDH1A1 (0.44) DGKAALDH1A1KDM4ETDP1LMNA
SCHEMBL18649182 0.77 ALDH1A1 (0.50) HRH3ADRB2ALDH1A1KDM4ETDP1
SCHEMBL17036647 0.76 ALDH1A1 (0.48) HRH3ADRB2ALDH1A1KDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-03-09 US disclosed
US-10189869-B2 Amino compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2019-01-29 US disclosed
US-20170189410-A1 Amino Compounds for Treatment of Complement Mediated Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-07-06 US disclosed
US-20170189410-A1 Amino Compounds for Treatment of Complement Mediated Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-07-06 US disclosed
US-9598446-B2 Amino compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-03-21 US disclosed
US-9598446-B2 Amino compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-03-21 US disclosed
US-20150239894-A1 Amino Compounds for Treatment of Complement Mediated Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2015-08-27 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-10189869-B2 Amino compounds for treatment of complement mediated disorders CFD, TFPI, C9 DGKA 4236/4885HRH3 592/4885ADRB2 2350/4885
US-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH DGKA 2456/4885HRH3 927/4885ADRB2 1016/4885
US-20150239894-A1 Amino Compounds for Treatment of Complement Mediated Disorders CFD, TFPI, C9 DGKA 4236/4885HRH3 592/4885ADRB2 2350/4885
US-20170189410-A1 Amino Compounds for Treatment of Complement Mediated Disorders CFD, TFPI, C9 DGKA 4236/4885HRH3 592/4885ADRB2 2350/4885

“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.