Methane

Methane

SCHEMBL7338694

C.CCC(C(=O)O)c1ccccc1

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.58
HSD17B10 Q99714 1/20 0.58
CYP2C19 P33261 1/20 0.55
ALDH1A1 P00352 1/20 0.53
POLB P06746 1/20 0.53
CRHBP P24387 2/20 0.51
CRHR2 Q13324 2/20 0.51
KCNQ2 O43526 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HDAC3 O15379 3/20 0.51
HDAC4 P56524 3/20 0.51
HDAC1 Q13547 3/20 0.51
HDAC7 Q8WUI4 3/20 0.51
HDAC2 Q92769 3/20 0.51
HDAC10 Q969S8 3/20 0.51
HDAC11 Q96DB2 3/20 0.51
HDAC8 Q9BY41 3/20 0.51
HDAC6 Q9UBN7 3/20 0.51
HDAC9 Q9UKV0 3/20 0.51

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
SCHEMBL65737 0.98 LMNA (0.59) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL67237 0.98 LMNA (0.59) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL20769804 0.98 LMNA (0.59) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL29757088 0.98 LMNA (0.59) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL1715 0.98 LMNA (0.59) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL9171150 0.96 LMNA (0.58) LMNAHSD17B10CYP2C19ALDH1A1POLB
Hydrochloric Acid SCHEMBL16820451 0.96 LMNA (0.58) LMNAHSD17B10CYP2C19ALDH1A1POLB
Hydrochloric Acid SCHEMBL2008283 0.96 LMNA (0.58) LMNAHSD17B10CYP2C19ALDH1A1POLB
SCHEMBL5598361 0.96 LMNA (0.58) LMNAHSD17B10CYP2C19ALDH1A1POLB
Phosphine SCHEMBL28961689 0.96 LMNA (0.58) LMNAHSD17B10CYP2C19ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114790136-A Preparation method and application of active trivalent organic chromium compound 中国石油天然气股份有限公司 2022-07-26 CN disclosed
EP-0048433-B1 NOVEL AMIDINE COMPOUNDS, PROCESS FOR PRODUCING SAME AND ANTI-COMPLEMENT AGENT COMPRISING THEM TORII & CO., LTD. (JP) 1986-05-28 EP disclosed
US-4532255-A Amidine compounds and anticomplement agent comprising same TORII & CO., LTD. (JP) 1985-07-30 US disclosed
US-4454338-A 6-AMIDINO-2-NATHTHYL-4-GUANIDINOBENZOATE TORII & CO., LTD. (JP) 1984-06-12 US disclosed
EP-0048433-A2 Novel amidine compounds, process for producing same and anti-complement agent comprising them TORII & CO., LTD. (JP) 1982-03-31 EP disclosed