P-Xylene

P-Xylene

SCHEMBL2589553

Cc1ccc(C)cc1.ClC(Cl)C(Cl)Cl

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.61
TDP1 Q9NUW8 2/20 0.61
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 4/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
HPGD P15428 1/20 0.43
TSHR P16473 3/20 0.41
LMNA P02545 2/20 0.41
ALOX12 P18054 1/20 0.41
CHRNA7 P36544 1/20 0.41
HTR3E A5X5Y0 1/20 0.39
SLC22A2 O15244 1/20 0.39
SLC22A1 O15245 1/20 0.39
SLC22A3 O75751 1/20 0.39
HTR3B O95264 1/20 0.39

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
P-Xylene SCHEMBL17784277 0.88 ACHE (0.67) ACHETDP1MEN1KMT2ASMN1; SMN2
P-Xylene SCHEMBL11301004 0.85 ACHE (0.61) ACHETDP1MEN1KMT2ASMN1; SMN2
P-Xylene SCHEMBL11553864 0.79 ACHE (0.80) ACHETDP1ALDH1A1CA1CA2
SCHEMBL24047104 0.78 TDP1 (0.59) ACHETDP1MEN1KMT2ASMN1; SMN2
P-Xylene SCHEMBL11772917 0.78 ACHE (1.00) ACHETDP1ALDH1A1CA1CA2
P-Xylene SCHEMBL11770184 0.78 ACHE (1.00) ACHETDP1ALDH1A1CA1CA2
P-Xylene SCHEMBL460348 0.78 ACHE (1.00) ACHETDP1ALDH1A1CA1CA2
P-Xylene SCHEMBL771 0.78
SCHEMBL330031 0.76 ACHE (0.50) ACHETDP1MEN1KMT2ASMN1; SMN2
SCHEMBL2457397 0.76 ACHE (0.50) ACHETDP1MEN1KMT2ASMN1; 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109689626-B Method for synthesizing near-infrared closed-chain sulfo-cyanine dye 直观外科手术操作公司 2022-11-08 CN disclosed
US-10759729-B2 Compounds for treating diabetes THE CHINESE UNIVERSITY OF HONG KONG (CN) 2020-09-01 US disclosed
EP-3481802-A1 METHOD OF SYNTHESIZING NEAR IR, CLOSED CHAIN SULFO-CYANINE DYES Intuitive Surgical Operations Inc. (US) 2019-05-15 EP disclosed
US-20180319987-A1 Method of Synthesizing Near IR, Closed Chain Sulfo-Cyanine Dyes Intuitive Surgical Operations, Inc. 2018-11-08 US disclosed
US-10053580-B2 Method of synthesizing near IR, closed chain sulfo-cyanine dyes Intuitive Surgical Operations, Inc. (US) 2018-08-21 US disclosed
US-20180127343-A1 NOVEL COMPOUNDS FOR TREATING DIABETES THE CHINESE UNIVERSITY OF HONG KONG (CN) 2018-05-10 US disclosed
US-20180009987-A1 Method of Synthesizing Near IR, Closed Chain Sulfo-Cyanine Dyes Intuitive Surgical Operations, Inc. (US) 2018-01-11 US disclosed
WO-2018009375-A1 METHOD OF SYNTHESIZING NEAR IR, CLOSED CHAIN SULFO-CYANINE DYES Intuitive Surgical Operations, Inc. (US) 2018-01-11 WO disclosed
US-9796854-B1 Method of synthesizing near IR, closed chain sulfo-cyanine dyes Intuitive Surgical Operations, Inc. (US) 2017-10-24 US disclosed
US-8722897-B2 Metal complexes of thiourea and derivatives as metal delivering anti-cancer and anti-inflammatory agents GOLDPORP PHARMA LIMITED (CN) 2014-05-13 US disclosed
US-20110269730-A1 Metal Complexes of Thiourea and Derivatives as Metal Delivering Anti-Cancer and Anti-Inflammatory Agents GOLDPORP PHARMA LIMITED (CN) 2011-11-03 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 (6 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-10759729-B2 Compounds for treating diabetes SLC5A2, GPR119, DPP4 ACHE 1563/4885TDP1 4601/4885MEN1 3092/4885
US-20180009987-A1 Method of Synthesizing Near IR, Closed Chain Sulfo-Cyanine Dyes SPR, IK, TST ACHE 2460/4885TDP1 3986/4885MEN1 3984/4885
US-10053580-B2 Method of synthesizing near IR, closed chain sulfo-cyanine dyes SPR, IK, TST ACHE 2460/4885TDP1 3986/4885MEN1 3984/4885
US-20110269730-A1 Metal Complexes of Thiourea and Derivatives as Metal Delivering Anti-Cancer and Anti-Inflammatory Agents CLIC1, SLC30A5, TIA1 ACHE 2075/4885TDP1 3633/4885MEN1 3790/4885
US-20180319987-A1 Method of Synthesizing Near IR, Closed Chain Sulfo-Cyanine Dyes SPR, IK, TST ACHE 2460/4885TDP1 3986/4885MEN1 3984/4885
US-20180127343-A1 NOVEL COMPOUNDS FOR TREATING DIABETES GPR119, SLC5A2, DPP4 ACHE 2370/4885TDP1 4614/4885MEN1 3406/4885

“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.