Cyclopropane

Cyclopropane

SCHEMBL6695009

C1CC1.CC(=O)NCc1ccccc1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.61
PTPN1 P18031 1/20 0.57
ALDH1A1 P00352 3/20 0.56
HPGD P15428 2/20 0.56
USP2 O75604 1/20 0.56
RAB9A P51151 2/20 0.56
EPHX1 P07099 1/20 0.56
NPC1 O15118 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.55
CYP2C9 P11712 2/20 0.54
GAA P10253 1/20 0.53
HDAC1 Q13547 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
HTR2A P28223 1/20 0.52
HTR2C P28335 1/20 0.52
HTR2B P41595 1/20 0.52
MEN1 O00255 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
TSHR P16473 1/20 0.52

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
SCHEMBL97001 0.94 KMT2A (0.68) KMT2APTPN1ALDH1A1HPGDRAB9A
Bromide SCHEMBL30703423 0.92 KMT2A (0.66) KMT2APTPN1ALDH1A1HPGDRAB9A
Acetic Acid SCHEMBL10568555 0.92 KMT2A (0.66) KMT2APTPN1ALDH1A1HPGDRAB9A
Hydrochloric Acid SCHEMBL27905582 0.92 KMT2A (0.66) KMT2APTPN1ALDH1A1HPGDRAB9A
SCHEMBL21758204 0.88 KMT2A (0.61) KMT2APTPN1ALDH1A1HPGDSMN1; SMN2
SCHEMBL3323001 0.88 KMT2A (0.61) KMT2APTPN1ALDH1A1HPGDRAB9A
Toluene SCHEMBL29122543 0.86 SMN1; SMN2 (0.68) KMT2APTPN1ALDH1A1HPGDRAB9A
Ethylenediamine SCHEMBL4062109 0.86 KIF11 (0.60) KMT2APTPN1ALDH1A1RAB9ASMN1; SMN2
N-Benzylmethylamine SCHEMBL2561295 0.86 MAPT (0.63) KMT2APTPN1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL28286652 0.85 KMT2A (0.58) KMT2APTPN1ALDH1A1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0950669-B1 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM & HAAS (US) 2004-09-08 EP disclosed
US-6306991-B1 TWO PART COATING COMPOSITION WITH TWO CONTAINERS, OXIDATIVE POLYMERS WITH CROSSLINKABLE FUNCTIONAL GROUPS ROHM AND HAAS COMPANY 2001-10-23 US disclosed
US-6149977-A CONTACTING THE OXIDATIVE POLYMER WITH A CATALYTIC AMOUNT OF AN OXIDIZING ENZYME, SUCH AS HORSERADISH PEROXIDASE. ROHM AND HAAS COMPANY (US) 2000-11-21 US disclosed
EP-0950669-A2 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM AND HAAS COMPANY (US) 1999-10-20 EP disclosed