Propylamine

Propylamine

SCHEMBL28734534

CCCN.O=C(c1ccccn1)c1ccccn1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.56
ALDH1A1 P00352 1/20 0.55
CES2 O00748 1/20 0.53
CES1 P23141 1/20 0.53
LMNA P02545 3/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
NAPRT Q6XQN6 1/20 0.52
P4HTM Q9NXG6 1/20 0.52
KDM4E B2RXH2 3/20 0.51
SMYD3 Q9H7B4 1/20 0.49
HSD17B14 Q9BPX1 1/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47

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
2-Picolinic Acid SCHEMBL28766129 0.87 LMNA (0.71) KMT2AALDH1A1CES2CES1LMNA
Alcohol SCHEMBL9405122 0.86 KMT2A (0.62) KMT2AALDH1A1CES2CES1LMNA
SCHEMBL31369148 0.84 KMT2A (0.75) KMT2AALDH1A1CES2CES1LMNA
SCHEMBL87791 0.84 KMT2A (0.75) KMT2AALDH1A1CES2CES1LMNA
Charcoal, Activated SCHEMBL8358164 0.82 KMT2A (0.72) KMT2AALDH1A1CES2CES1LMNA
Water SCHEMBL6228901 0.82 KMT2A (0.72) KMT2AALDH1A1CES2CES1LMNA
SCHEMBL31369119 0.82 KMT2A (0.72) KMT2AALDH1A1CES2CES1LMNA
Hydrochloric Acid SCHEMBL27723543 0.82 KMT2A (0.72) KMT2AALDH1A1CES2CES1LMNA
Acetic Acid SCHEMBL28040553 0.80 KMT2A (0.70) KMT2AALDH1A1CES2CES1LMNA
Butane SCHEMBL11072622 0.79 ALDH1A1 (0.57) KMT2AALDH1A1CES2CES1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114471718-A Catalytic system for ethylene selective oligomerization and ethylene selective oligomerization method 中国石油天然气股份有限公司 2022-05-13 CN disclosed