SCHEMBL8662167

SCHEMBL8662167

N=C(N)NCCCCC(NN)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GNPAT O15228 3/20 0.45
FOLH1 Q04609 11/20 0.41
ALOX15 P16050 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
KMT2A Q03164 1/20 0.40
NOD1 Q9Y239 1/20 0.34

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
SCHEMBL8663718 1.00 GNPAT (0.45) GNPATFOLH1ALOX15SMN1; SMN2MEN1
SCHEMBL7196910 0.95 GNPAT (0.46) GNPATFOLH1ALOX15SMN1; SMN2MEN1
SCHEMBL408774 0.95 GNPAT (0.46) GNPATFOLH1ALOX15SMN1; SMN2MEN1
SCHEMBL27043232 0.95 GNPAT (0.46) GNPATFOLH1ALOX15SMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL18222331 0.93 GNPAT (0.45) GNPATFOLH1ALOX15SMN1; SMN2MEN1
SCHEMBL564120 0.86 FOLH1 (0.41) GNPATFOLH1ALOX15SMN1; SMN2MEN1
SCHEMBL27532875 0.86 FOLH1 (0.41) GNPATFOLH1ALOX15SMN1; SMN2MEN1
SCHEMBL30986312 0.85 FOLH1 (0.40) FOLH1ALOX15SMN1; SMN2MEN1CYP1A2
SCHEMBL29888878 0.85 FOLH1 (0.43) FOLH1ALOX15SMN1; SMN2MEN1CYP1A2
SCHEMBL350358 0.85 FOLH1 (0.43) FOLH1ALOX15SMN1; SMN2MEN1CYP1A2

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
US-20230220387-A1 D-SERINE TRANSPORT MODIFIER AND SCREENING METHOD THEREOF, AND SCREENING METHOD OF D-SERINE TRANSPORTER PROTEIN KAGAMI INC. (JP) 2023-07-13 US claimed
WO-2021132691-A1 D-SERINE TRANSPORT MODIFIER AND SCREENING METHOD THEREOF, AND SCREENING METHOD OF D-SERINE TRANSPORTER PROTEIN KAGAMI株式会社 2021-07-01 WO claimed
US-20230220387-A1 D-SERINE TRANSPORT MODIFIER AND SCREENING METHOD THEREOF, AND SCREENING METHOD OF D-SERINE TRANSPORTER PROTEIN KAGAMI INC. (JP) 2023-07-13 US disclosed
WO-2021132691-A1 D-SERINE TRANSPORT MODIFIER AND SCREENING METHOD THEREOF, AND SCREENING METHOD OF D-SERINE TRANSPORTER PROTEIN KAGAMI株式会社 2021-07-01 WO disclosed
EP-0649303-B1 SUBSTITUTED ARGININES AND SUBSTITUTED HOMOARGININES AND USE THEREOF CORNELL RES FOUNDATION INC (US) 1998-11-25 EP disclosed
EP-0649303-A4 SUBSTITUTED ARGININES AND SUBSTITUTED HOMOARGININES AND USE THEREOF. CORNELL RES FOUNDATION INC (US) 1995-07-05 EP disclosed
EP-0649303-A1 SUBSTITUTED ARGININES AND SUBSTITUTED HOMOARGININES AND USE THEREOF CORNELL RESEARCH FOUNDATION, INC. (US) 1995-04-26 EP disclosed
WO-1993024126-A1 SUBSTITUTED ARGININES AND SUBSTITUTED HOMOARGININES AND USE THEREOF CORNELL RESEARCH FOUNDATION, INC. (US) 1993-12-09 WO disclosed